data_1ret_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 1ret _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 ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -70.38 -24.6 62.98 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.948 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -67.19 0.42 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.426 -0.796 . . . . 0.0 109.997 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.7 t -65.45 -32.39 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.5 -0.75 . . . . 0.0 109.643 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.03 -22.49 64.61 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.588 -0.695 . . . . 0.0 110.374 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -92.86 -44.05 8.68 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.428 ' HG2' ' HB3' ' A' ' 28' ' ' MET . 1.7 mpp? -61.69 -14.1 28.61 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.462 -0.774 . . . . 0.0 111.615 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.548 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 69.0 m95 -113.0 -42.72 3.51 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.725 -1.235 . . . . 0.0 110.869 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -75.64 -3.96 37.48 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.527 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -95.36 -29.3 14.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.089 -1.007 . . . . 0.0 109.519 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.94 75.94 0.42 Allowed Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 14' ' ' MET . 4.9 mp -133.25 -173.43 3.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.483 -1.01 . . . . 0.0 110.031 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.428 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.61 116.97 0.74 Allowed Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.03 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.469 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 29.01 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 22.0 t -61.76 -56.4 19.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 110.667 -178.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -57.92 -27.6 63.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.482 -0.761 . . . . 0.0 110.533 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.497 ' CD1' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -72.45 -39.01 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.806 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.65 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 99.1 p -65.2 -46.32 81.22 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.695 -0.628 . . . . 0.0 110.052 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -28.14 67.21 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.743 . . . . 0.0 109.829 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 m -79.32 -38.46 35.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.528 -0.732 . . . . 0.0 110.361 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.428 ' HB3' ' HG2' ' A' ' 14' ' ' MET . 2.6 ptt? -110.27 -153.22 0.51 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -120.4 46.75 1.91 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.263 -0.898 . . . . 0.0 112.315 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 pt -153.91 148.58 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 120.801 -1.187 . . . . 0.0 110.636 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.73 174.28 1.08 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.653 -0.654 . . . . 0.0 109.836 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HB2' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -75.61 -41.48 54.33 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 111.662 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.411 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 4.9 t -68.93 -37.42 78.89 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.4 m -64.06 -37.3 86.93 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.437 ' O ' HG12 ' A' ' 39' ' ' ILE . 14.4 t -60.37 -41.2 86.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.7 m-85 -70.25 -18.42 63.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.973 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -59.98 -36.63 77.55 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 174.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.4 t -72.82 -57.44 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.449 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.548 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 6.0 mm -52.98 -31.35 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.837 0.827 . . . . 0.0 110.61 -176.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -74.34 -41.0 61.79 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -60.65 -33.31 72.63 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.709 -0.619 . . . . 0.0 109.796 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.497 1.884 0 O-C-N 121.49 -0.756 . . . . 0.0 109.725 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? . . . . . 0 N--CA 1.483 1.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -22.67 65.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.559 -0.713 . . . . 0.0 109.976 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.94 -50.86 30.03 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.408 -0.807 . . . . 0.0 109.769 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.8 t -60.65 -44.65 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.504 -0.747 . . . . 0.0 109.429 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.55 -30.97 72.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.779 -0.576 . . . . 0.0 109.786 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -66.26 -30.71 71.2 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.377 -0.827 . . . . 0.0 110.142 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.449 ' HG3' ' CB ' ' A' ' 28' ' ' MET . 6.6 mmt -70.89 -56.48 6.18 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 121.429 -0.794 . . . . 0.0 110.285 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.569 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 98.3 m95 -58.86 -40.03 83.12 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.318 -0.864 . . . . 0.0 111.494 -178.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -67.95 -16.31 64.0 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.823 -0.548 . . . . 0.0 111.891 -176.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -94.82 22.04 6.86 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.161 -0.962 . . . . 0.0 110.773 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.95 54.08 7.42 Favored Glycine 0 N--CA 1.5 2.939 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.522 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 8.5 mp -122.91 -170.8 2.17 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.924 . . . . 0.0 108.938 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.502 ' N ' HG12 ' A' ' 24' ' ' ILE . . . 178.39 116.13 0.48 Allowed Glycine 0 N--CA 1.499 2.864 0 C-N-CA 119.376 -1.392 . . . . 0.0 112.899 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 32.55 -78.98 0.0 OUTLIER 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 20' ' ' GLY . 29.6 t -44.16 -42.51 6.45 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.522 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 7.2 t60 -94.57 -29.47 14.87 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 177.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.502 HG12 ' N ' ' A' ' 20' ' ' GLY . 16.6 mm -76.19 8.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 121.217 -0.927 . . . . 0.0 110.762 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.7 m -137.4 -35.13 0.68 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.052 -1.03 . . . . 0.0 111.05 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.36 -36.22 16.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.833 -1.167 . . . . 0.0 110.305 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 32.2 m -91.39 -28.84 17.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.42 -0.8 . . . . 0.0 111.301 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.449 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -101.01 34.18 2.59 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.232 -0.917 . . . . 0.0 109.402 -178.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 33.95 58.64 0.59 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.404 ' CD1' ' CG2' ' A' ' 35' ' ' VAL . 6.0 pt -157.79 172.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.524 -0.735 . . . . 0.0 109.054 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.418 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -96.69 156.4 16.36 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -78.0 -45.93 22.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.848 -1.158 . . . . 0.0 111.53 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.99 -42.25 97.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.11 -0.994 . . . . 0.0 108.943 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.2 m -63.68 -44.84 92.55 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 122.574 1.178 . . . . 0.0 108.236 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.492 ' CG1' HD12 ' A' ' 39' ' ' ILE . 12.0 t -63.4 -21.5 28.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.679 ' HA ' HD13 ' A' ' 39' ' ' ILE . 2.1 m-85 -79.08 -24.54 43.43 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.21 -0.931 . . . . 0.0 110.137 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 mtpt -61.96 -37.45 84.8 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.86 -54.28 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.997 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.679 HD13 ' HA ' ' A' ' 36' ' ' TYR . 12.2 mt -53.99 -30.74 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 O-C-N 121.449 -0.782 . . . . 0.0 110.077 -178.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -72.69 -41.19 65.56 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.97 22.58 7.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.773 -0.579 . . . . 0.0 109.863 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.6 t . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 109.423 179.979 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.13 -23.33 62.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.626 -0.671 . . . . 0.0 109.972 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.34 -55.74 25.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.388 -0.82 . . . . 0.0 109.731 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -66.89 -42.1 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.493 -0.755 . . . . 0.0 109.285 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -26.45 61.85 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.567 -0.708 . . . . 0.0 109.946 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -86.8 -32.64 20.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.367 -0.833 . . . . 0.0 109.357 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.413 ' HB3' HG21 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -82.64 5.11 22.19 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.623 -0.673 . . . . 0.0 111.141 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.582 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 10.1 m95 -128.24 -49.47 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.386 1.089 . . . . 0.0 109.691 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.06 -15.25 61.51 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.008 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -80.16 -27.68 38.94 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.191 -0.943 . . . . 0.0 109.48 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.77 65.85 0.26 Allowed Glycine 0 N--CA 1.496 2.64 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.448 ' CB ' HG12 ' A' ' 24' ' ' ILE . 4.9 mp -127.98 -171.74 2.52 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.497 -1.002 . . . . 0.0 110.158 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.439 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -154.55 112.21 0.52 Allowed Glycine 0 N--CA 1.496 2.677 0 C-N-CA 119.647 -1.263 . . . . 0.0 111.777 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 16.25 -74.31 0.0 OUTLIER 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.4 p -48.65 -59.35 3.59 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.179 -0.951 . . . . 0.0 110.776 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.417 ' CD2' HD22 ' A' ' 19' ' ' LEU . 6.1 t60 -64.93 -37.51 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.537 ' CD1' ' CZ3' ' A' ' 15' ' ' TRP . 78.8 mt -66.73 -14.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.813 -0.554 . . . . 0.0 110.283 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 p -81.18 -40.79 23.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 108.789 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -55.33 16.84 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 t -62.64 -48.24 80.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.638 -0.664 . . . . 0.0 109.461 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' ' 24' ' ' ILE . 0.0 OUTLIER -107.44 93.57 4.62 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 178.506 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -47.94 96.36 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.2 pt -172.01 147.95 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 177.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.419 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -61.27 155.92 19.92 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.438 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.4 OUTLIER -64.31 -35.2 80.08 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.185 -0.947 . . . . 0.0 111.244 -178.361 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.438 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 86.9 p -75.42 -36.73 60.73 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.144 -0.973 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.7 m -61.8 -34.96 76.85 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.512 ' CG1' HD13 ' A' ' 39' ' ' ILE . 8.9 t -66.08 -34.79 72.61 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.39 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.652 ' HA ' HD11 ' A' ' 39' ' ' ILE . 16.1 m-85 -75.25 -13.3 60.43 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.85 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -68.98 -38.4 79.3 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 174.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.7 -54.38 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.094 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.652 HD11 ' HA ' ' A' ' 36' ' ' TYR . 5.6 mt -56.07 -34.26 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.414 -0.804 . . . . 0.0 109.563 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -69.79 -40.71 75.85 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -59.94 -28.75 67.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.923 -0.485 . . . . 0.0 109.773 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.53 -0.731 . . . . 0.0 109.346 179.909 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 121.034 0.445 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -62.27 -31.05 71.57 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.521 -0.737 . . . . 0.0 109.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.53 -42.04 98.45 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.585 -0.697 . . . . 0.0 109.881 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.6 -49.28 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.529 -0.732 . . . . 0.0 109.076 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.65 -8.71 57.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.733 -0.604 . . . . 0.0 110.486 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -38.03 48.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.866 -1.147 . . . . 0.0 109.748 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.465 ' HB3' HG21 ' A' ' 24' ' ' ILE . 15.9 mmt -83.66 -45.26 13.64 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.495 -0.753 . . . . 0.0 110.45 -179.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.575 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 35.0 m95 -55.14 -51.24 67.08 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.924 -1.11 . . . . 0.0 110.14 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -63.68 -28.27 69.79 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.472 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -73.89 -29.31 62.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.281 -0.887 . . . . 0.0 109.318 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.94 65.32 0.23 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 0.6 OUTLIER -133.47 160.56 37.05 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.446 -1.032 . . . . 0.0 109.963 -179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.46 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -138.59 121.91 2.26 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.484 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.42 ' N ' ' CD1' ' A' ' 24' ' ' ILE . . . 28.45 -83.4 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.5 t -64.43 -56.35 14.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.411 -0.806 . . . . 0.0 111.235 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.446 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 82.1 t60 -57.04 -30.03 63.9 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.369 -0.832 . . . . 0.0 110.21 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.559 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -74.49 -34.61 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.7 p -62.78 -34.58 77.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.634 -0.666 . . . . 0.0 109.331 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -34.83 78.8 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.407 ' O ' ' CE ' ' A' ' 28' ' ' MET . 2.2 m -88.89 -76.42 0.4 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.823 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.491 ' HA ' ' HE3' ' A' ' 28' ' ' MET . 19.1 mmt -155.79 82.78 1.02 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.282 -0.886 . . . . 0.0 110.032 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.501 ' O ' ' O ' ' A' ' 30' ' ' ILE . 1.6 t-20 -152.74 -41.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.726 -1.234 . . . . 0.0 112.756 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.501 ' O ' ' O ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER 50.75 145.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.915 0 CA-C-O 121.834 0.826 . . . . 0.0 112.359 -177.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.402 ' O ' ' O ' ' A' ' 30' ' ' ILE . . . 40.03 97.27 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.684 -0.635 . . . . 0.0 111.248 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.402 ' CD ' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -68.61 -42.53 77.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.969 -1.082 . . . . 0.0 112.535 -177.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 70.8 m -63.72 -43.9 95.18 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.045 -1.035 . . . . 0.0 108.845 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -63.1 -36.22 82.86 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.176 0.988 . . . . 0.0 108.617 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.47 ' CG1' HD12 ' A' ' 39' ' ' ILE . 38.0 t -65.2 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.674 ' HA ' HD13 ' A' ' 39' ' ' ILE . 4.6 m-85 -75.48 -21.0 58.43 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -64.18 -36.23 83.39 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 175.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.41 -56.12 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.162 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.674 HD13 ' HA ' ' A' ' 36' ' ' TYR . 5.7 mt -55.53 -32.49 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.356 -0.84 . . . . 0.0 109.828 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -69.75 -40.4 76.15 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -62.73 -30.26 71.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.769 -0.582 . . . . 0.0 109.569 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.626 -0.671 . . . . 0.0 109.437 179.994 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.041 0.448 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.17 -33.96 75.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.586 -0.696 . . . . 0.0 109.424 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.86 70.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.595 -0.69 . . . . 0.0 109.425 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.35 -50.69 71.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.01 -23.81 67.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.669 -0.644 . . . . 0.0 109.718 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -63.28 -45.32 91.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.169 -0.957 . . . . 0.0 109.698 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.447 ' HB3' HD13 ' A' ' 19' ' ' LEU . 9.6 mmt -64.27 -43.11 95.84 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.463 -0.773 . . . . 0.0 110.025 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.564 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 80.0 m95 -67.78 -25.02 65.4 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.003 -1.061 . . . . 0.0 112.184 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -97.1 13.12 30.27 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.535 -0.728 . . . . 0.0 112.476 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -105.85 -22.25 12.97 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.073 -1.017 . . . . 0.0 110.562 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.44 -49.68 0.81 Allowed Glycine 0 N--CA 1.498 2.785 0 N-CA-C 108.42 -1.872 . . . . 0.0 108.42 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.468 ' CD1' ' CD2' ' A' ' 23' ' ' HIS . 0.2 OUTLIER -48.47 173.78 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 122.015 -0.697 . . . . 0.0 110.979 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.472 ' CA ' HG12 ' A' ' 24' ' ' ILE . . . -167.45 135.64 3.75 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.954 -1.117 . . . . 0.0 111.503 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 36.68 -83.41 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.442 ' N ' ' O ' ' A' ' 20' ' ' GLY . 2.9 m -47.99 -52.26 20.51 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.383 -0.823 . . . . 0.0 109.468 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.468 ' CD2' ' CD1' ' A' ' 19' ' ' LEU . 4.9 t60 -78.77 -31.65 46.22 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 177.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.472 HG12 ' CA ' ' A' ' 20' ' ' GLY . 19.1 mm -71.7 1.73 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.284 -0.885 . . . . 0.0 110.525 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 t -110.64 -67.02 1.02 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.835 -1.165 . . . . 0.0 110.031 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -26.43 68.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.614 -0.679 . . . . 0.0 110.555 -178.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 m -90.89 -37.33 13.63 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.35 -0.844 . . . . 0.0 111.424 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.414 ' CE ' HG12 ' A' ' 35' ' ' VAL . 48.9 ttp -91.5 -80.12 0.36 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.138 -0.976 . . . . 0.0 109.972 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -137.25 -61.35 0.65 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.017 -1.052 . . . . 0.0 113.079 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.4 pp -155.0 -177.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.987 -1.07 . . . . 0.0 112.279 -176.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -34.92 142.14 0.05 Allowed 'General case' 0 N--CA 1.505 2.295 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.34 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -65.76 -22.2 66.57 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.92 -0.487 . . . . 0.0 111.895 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.1 t -64.22 -50.63 67.26 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.9 m -63.92 -38.93 92.9 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.487 1.137 . . . . 0.0 107.975 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.505 ' CG1' HD13 ' A' ' 39' ' ' ILE . 39.7 t -61.69 -26.35 39.47 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.446 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.627 ' HA ' HD11 ' A' ' 39' ' ' ILE . 6.5 m-85 -78.59 -23.99 45.68 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.569 -0.707 . . . . 0.0 110.395 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -38.27 83.54 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -76.5 -53.61 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.421 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 36' ' ' TYR . 14.8 mt -53.35 -30.76 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.425 -0.797 . . . . 0.0 110.183 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.5 -42.49 52.71 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -61.49 -23.28 65.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.846 -0.534 . . . . 0.0 110.009 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.072 0 O-C-N 121.572 -0.705 . . . . 0.0 109.692 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -82.06 -20.13 38.88 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.583 -0.698 . . . . 0.0 110.226 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.41 67.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.0 109.805 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.48 -53.35 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.538 -0.726 . . . . 0.0 109.611 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.23 -40.33 70.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.603 -0.686 . . . . 0.0 110.742 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -76.86 -40.87 46.15 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.663 -0.648 . . . . 0.0 111.991 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.419 ' O ' ' CG2' ' A' ' 24' ' ' ILE . 0.0 OUTLIER -85.1 10.11 13.0 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.071 -1.018 . . . . 0.0 111.632 -178.177 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.56 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 6.4 m95 -121.52 -53.1 2.01 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.842 -1.161 . . . . 0.0 109.9 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -76.79 -16.84 59.34 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.157 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -74.21 -27.22 60.69 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.205 -0.934 . . . . 0.0 109.104 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.49 66.93 0.12 Allowed Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.462 HD11 ' CD2' ' A' ' 23' ' ' HIS . 2.6 mm? -126.02 -173.43 2.85 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.46 -1.023 . . . . 0.0 110.645 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -170.24 112.79 0.48 Allowed Glycine 0 N--CA 1.49 2.26 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.457 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 27.32 -83.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.8 m -60.61 -56.57 19.78 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.3 -0.875 . . . . 0.0 110.791 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.462 ' CD2' HD11 ' A' ' 19' ' ' LEU . 7.4 t60 -58.02 -30.51 66.17 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.526 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -67.97 -36.36 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.772 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.8 t -59.66 -29.94 68.41 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.475 -0.765 . . . . 0.0 109.285 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.36 -52.07 50.7 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.595 -0.691 . . . . 0.0 109.142 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 54.6 m -74.23 -72.3 0.29 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 1.9 ttm -80.93 99.01 8.15 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -57.57 88.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.958 -0.464 . . . . 0.0 111.076 -178.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -160.51 160.97 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 O-C-N 121.463 -0.773 . . . . 0.0 110.04 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.59 151.53 47.16 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.414 ' HB2' ' CB ' ' A' ' 21' ' ' ALA . 5.1 ptt-85 -75.44 -43.36 50.11 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.358 -0.839 . . . . 0.0 111.459 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.404 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -63.82 -43.17 97.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 109.183 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.3 m -57.73 -43.37 85.26 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.711 1.243 . . . . 0.0 108.323 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.471 ' O ' HG12 ' A' ' 39' ' ' ILE . 3.2 t -58.93 -37.43 67.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.481 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 4.1 m-85 -71.02 -22.33 62.16 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.478 -0.889 . . . . 0.0 111.43 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mppp? -59.12 -36.36 75.05 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 175.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -71.74 -55.52 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.419 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.56 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 7.4 mm -53.36 -31.84 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.255 0 CA-C-O 121.842 0.83 . . . . 0.0 110.622 -176.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -71.83 -41.93 67.59 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -91.38 16.67 9.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.709 -0.619 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 109.427 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 121.384 0.611 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -69.23 -23.22 63.85 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.524 -0.735 . . . . 0.0 109.828 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.44 -61.7 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.461 -0.775 . . . . 0.0 109.695 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 t -57.99 -34.17 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.468 -0.77 . . . . 0.0 109.762 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.03 -35.52 80.06 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -65.09 -27.82 69.03 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' A' ' 19' ' ' LEU . 45.1 mtt -69.36 -65.87 0.66 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.472 -0.767 . . . . 0.0 110.38 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 88.7 m95 -68.88 -16.09 63.67 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.442 -0.786 . . . . 0.0 112.861 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -93.08 -0.93 56.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 112.275 -177.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -111.03 22.24 15.51 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.998 -1.064 . . . . 0.0 110.751 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.01 55.5 5.77 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.505 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 8.6 mp -123.61 -168.68 1.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.546 -0.973 . . . . 0.0 109.261 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -177.94 116.47 0.54 Allowed Glycine 0 N--CA 1.497 2.756 0 C-N-CA 119.701 -1.238 . . . . 0.0 112.175 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 30.6 -79.33 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.976 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 178.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -45.62 -54.6 7.46 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.485 -0.759 . . . . 0.0 109.435 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.505 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 6.8 t60 -76.64 -32.64 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.482 HG22 ' CE2' ' A' ' 15' ' ' TRP . 16.9 mm -70.67 0.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 121.428 -0.795 . . . . 0.0 110.676 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.408 ' CB ' ' N ' ' A' ' 32' ' ' ARG . 51.9 p -138.19 -0.27 2.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.976 -1.077 . . . . 0.0 111.958 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -117.3 -39.7 3.16 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 120.891 -1.131 . . . . 0.0 108.312 -179.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 59.9 m -90.53 -27.43 19.18 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.607 -0.683 . . . . 0.0 109.182 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.436 ' HG3' ' CG ' ' A' ' 14' ' ' MET . 4.0 mmm -81.38 -125.79 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -143.26 26.67 1.63 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 121.265 1.848 . . . . 0.0 113.364 -178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.465 HD11 HG22 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -156.49 -177.16 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.676 -1.265 . . . . 0.0 110.952 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.415 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -87.71 152.57 22.04 Favored 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.408 ' N ' ' CB ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -63.85 -39.9 95.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.188 -0.945 . . . . 0.0 112.178 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.6 t -61.7 -44.37 97.07 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.187 -0.946 . . . . 0.0 109.084 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.7 m -62.69 -35.65 80.4 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 122.121 0.962 . . . . 0.0 108.583 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.506 ' CG1' HD13 ' A' ' 39' ' ' ILE . 43.9 t -63.99 -30.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.662 ' HA ' HD11 ' A' ' 39' ' ' ILE . 7.1 m-85 -75.99 -20.35 57.93 Favored 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 119.81 -0.756 . . . . 0.0 110.413 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -63.18 -37.37 86.97 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.82 -54.13 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.605 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.662 HD11 ' HA ' ' A' ' 36' ' ' TYR . 6.8 mt -55.03 -33.02 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.306 -0.871 . . . . 0.0 109.838 -177.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.45 -39.71 62.37 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -97.94 23.65 7.82 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.906 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.493 1.682 0 O-C-N 121.45 -0.781 . . . . 0.0 109.49 179.984 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.35 0.595 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.68 -30.86 71.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 109.325 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.9 -53.18 58.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.582 -0.699 . . . . 0.0 109.303 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.4 t -61.01 -30.9 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.555 -0.716 . . . . 0.0 109.557 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 6.7 tp -58.98 -35.69 73.63 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.703 -0.623 . . . . 0.0 109.64 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -85.82 -16.6 38.2 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.521 -0.737 . . . . 0.0 110.465 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.459 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -67.3 -48.71 66.82 Favored 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.363 -0.836 . . . . 0.0 110.846 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.566 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 92.6 m95 -102.41 -30.86 10.77 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.557 -1.339 . . . . 0.0 112.315 -178.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.6 mm-40 -71.34 -22.43 61.91 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -177.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.27 -32.37 38.23 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.332 -0.855 . . . . 0.0 109.098 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.77 63.97 0.43 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 2.5 mp -122.47 -178.94 4.04 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.41 -1.053 . . . . 0.0 109.98 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.443 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -152.09 118.62 0.91 Allowed Glycine 0 N--CA 1.496 2.691 0 C-N-CA 119.974 -1.107 . . . . 0.0 111.515 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.484 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 32.99 -86.02 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t -67.1 -52.13 45.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.263 -0.898 . . . . 0.0 110.577 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.462 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 82.8 t60 -58.87 -38.92 79.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.534 -0.729 . . . . 0.0 110.04 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.498 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -57.29 -35.3 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.582 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -68.53 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.114 0.483 . . . . 0.0 109.848 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -27.61 65.1 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.1 m -90.43 -67.22 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.466 -0.771 . . . . 0.0 111.162 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -92.82 23.87 3.93 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.209 -0.932 . . . . 0.0 111.597 -178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 36.48 84.37 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 177.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -160.25 145.7 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.366 -0.833 . . . . 0.0 109.585 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.3 149.31 33.88 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.208 -0.933 . . . . 0.0 109.102 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' A' ' 33' ' ' SER . 35.0 ptt180 -74.26 -41.15 61.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.244 -0.91 . . . . 0.0 111.948 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -67.14 -44.1 80.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 108.544 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.9 m -59.4 -40.08 85.45 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.8 1.286 . . . . 0.0 107.992 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.512 ' O ' HD11 ' A' ' 39' ' ' ILE . 5.8 t -60.09 -37.26 72.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.648 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.636 ' HA ' HD11 ' A' ' 39' ' ' ILE . 4.7 m-85 -67.64 -23.27 65.32 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.997 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -62.96 -35.35 79.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.87 -60.57 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.664 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.636 HD11 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mp -54.99 -31.56 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 CA-C-O 121.718 0.77 . . . . 0.0 109.939 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -67.07 -42.64 84.35 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -100.67 25.22 8.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.731 -0.605 . . . . 0.0 109.701 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 N--CA 1.493 1.704 0 O-C-N 121.471 -0.768 . . . . 0.0 109.577 -179.911 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 121.181 0.515 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -70.23 -29.11 65.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.536 -0.727 . . . . 0.0 109.811 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.57 87.88 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.418 -0.801 . . . . 0.0 109.833 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.414 HG11 ' CD1' ' A' ' 15' ' ' TRP . 38.3 t -62.48 -48.53 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 109.052 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.56 -15.9 59.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.72 -0.612 . . . . 0.0 110.503 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -77.46 -43.52 32.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.924 -1.11 . . . . 0.0 110.409 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.423 ' HA ' HD11 ' A' ' 19' ' ' LEU . 27.0 mmt -77.99 -48.75 15.51 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.341 -0.85 . . . . 0.0 111.093 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.53 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 83.5 m95 -63.69 -47.4 81.31 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.821 -1.175 . . . . 0.0 111.491 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -67.81 -36.55 80.61 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.88 -0.513 . . . . 0.0 110.854 -177.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -63.05 -24.0 67.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.278 -0.889 . . . . 0.0 109.944 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.47 62.45 0.57 Allowed Glycine 0 N--CA 1.496 2.662 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.46 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 2.1 mp -130.72 -172.98 2.95 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.648 -0.913 . . . . 0.0 110.063 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -140.93 129.4 4.08 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . -15.27 -44.86 0.0 OUTLIER 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 124.837 1.255 . . . . 0.0 114.021 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.3 m -48.84 -74.03 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.282 -0.886 . . . . 0.0 109.81 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.46 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 1.3 p-80 -85.98 2.64 45.47 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 121.271 -0.893 . . . . 0.0 111.332 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.507 ' CD1' ' CE3' ' A' ' 15' ' ' TRP . 20.6 mt -75.3 -37.29 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 177.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -91.6 -26.95 18.46 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -42.44 82.83 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.371 -0.831 . . . . 0.0 109.007 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.3 m -79.39 -45.34 19.7 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.33 110.46 22.22 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -37.96 89.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.1 pt -179.46 176.2 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -98.8 162.66 12.98 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.307 -0.87 . . . . 0.0 109.13 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 33' ' ' SER . 28.4 ptt180 -77.5 -38.3 49.29 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.2 -0.937 . . . . 0.0 110.607 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -73.7 -39.45 64.34 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.1 m -61.07 -39.69 90.86 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.596 1.189 . . . . 0.0 107.829 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 39' ' ' ILE . 14.0 t -61.01 -41.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 5.1 m-85 -68.4 -19.76 64.63 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.845 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -59.76 -37.37 78.84 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.38 -56.65 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.325 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.53 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 7.5 mm -52.21 -31.47 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 CA-C-O 121.796 0.808 . . . . 0.0 110.581 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -74.07 -41.82 61.13 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -96.7 23.51 6.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.795 -0.566 . . . . 0.0 109.851 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.435 -0.791 . . . . 0.0 109.451 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 . . . . . 0 N--CA 1.502 2.159 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.92 -23.8 61.7 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.955 -1.091 . . . . 0.0 110.154 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -47.5 76.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.8 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.52 -57.89 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.2 tt -53.4 -23.23 9.2 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.827 -0.546 . . . . 0.0 110.952 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -72.59 -40.01 66.92 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.395 -0.816 . . . . 0.0 110.396 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.44 ' HG3' ' CB ' ' A' ' 28' ' ' MET . 11.4 mmt -67.72 -45.43 75.05 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.433 -0.792 . . . . 0.0 111.682 -178.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.609 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 62.9 m95 -70.61 -27.57 64.18 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.121 -0.987 . . . . 0.0 110.577 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -81.83 -18.66 43.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.483 -0.761 . . . . 0.0 110.432 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -85.09 -31.43 23.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.0 109.681 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.24 -0.61 7.05 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.456 ' HG ' ' CD2' ' A' ' 23' ' ' HIS . 0.4 OUTLIER -62.42 -176.48 0.11 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.111 -1.229 . . . . 0.0 109.906 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -155.24 121.5 1.11 Allowed Glycine 0 N--CA 1.494 2.526 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.262 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 20.57 -80.46 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.412 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.3 t -44.45 -59.91 2.2 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.535 -0.728 . . . . 0.0 111.089 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.456 ' CD2' ' HG ' ' A' ' 19' ' ' LEU . 5.9 t60 -67.38 -40.07 85.69 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.451 -0.781 . . . . 0.0 109.251 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.499 HD12 ' CD2' ' A' ' 15' ' ' TRP . 62.8 mt -69.12 -7.91 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.517 -0.739 . . . . 0.0 111.045 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.1 m -113.92 -71.78 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.477 -0.764 . . . . 0.0 111.266 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -38.72 73.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.851 -1.155 . . . . 0.0 110.29 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.405 ' CG2' ' HE1' ' A' ' 28' ' ' MET . 13.0 m -93.16 -27.17 17.06 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.963 -0.695 . . . . 0.0 111.969 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.44 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 13.8 mmt -118.08 -42.71 2.79 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.058 -1.026 . . . . 0.0 112.049 -177.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.427 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 7.6 m-80 -119.52 -93.5 0.52 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.887 -1.133 . . . . 0.0 111.473 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.427 ' CG2' ' O ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 175.2 114.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 O-C-N 121.135 -0.978 . . . . 0.0 109.438 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 61.58 143.63 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.395 -0.816 . . . . 0.0 110.042 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.4 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.4 OUTLIER -82.61 -45.85 14.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.067 -1.021 . . . . 0.0 111.873 -178.441 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.4 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 59.4 p -62.41 -42.42 99.43 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.126 -0.983 . . . . 0.0 108.526 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.2 m -63.43 -49.68 72.79 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 39' ' ' ILE . 2.7 t -56.92 -22.08 15.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.368 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.46 ' CE1' HD11 ' A' ' 39' ' ' ILE . 1.1 m-85 -75.79 -36.33 59.81 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.897 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -55.39 -36.34 66.29 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -50.23 77.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.824 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.609 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 5.0 mt -57.4 -38.36 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-O 121.537 0.684 . . . . 0.0 109.946 -177.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.49 -39.15 92.55 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -63.35 -29.55 70.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.823 -0.548 . . . . 0.0 109.642 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.563 -0.711 . . . . 0.0 109.797 -179.916 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 121.211 0.529 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -63.43 -24.8 67.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.496 -0.752 . . . . 0.0 109.86 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -44.82 95.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.43 -0.793 . . . . 0.0 109.827 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.0 t -62.8 -50.27 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.341 -0.849 . . . . 0.0 108.998 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.6 tt -56.36 -29.42 61.37 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.896 -0.502 . . . . 0.0 110.678 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -70.34 -33.83 71.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.455 -0.778 . . . . 0.0 110.098 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.513 ' HG3' ' HB2' ' A' ' 28' ' ' MET . 30.7 mmt -65.3 -47.98 74.71 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.561 -0.712 . . . . 0.0 110.007 -179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.677 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 78.9 m95 -62.42 -33.2 74.32 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.11 -0.994 . . . . 0.0 110.177 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -63.35 -22.19 66.73 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.684 -0.635 . . . . 0.0 110.742 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.61 22.54 4.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.357 -0.839 . . . . 0.0 110.35 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.06 54.85 10.27 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.435 ' CD2' HG21 ' A' ' 24' ' ' ILE . 4.8 mp -110.01 162.97 14.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.551 -0.97 . . . . 0.0 110.455 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.466 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -154.35 119.17 0.91 Allowed Glycine 0 N--CA 1.499 2.87 0 C-N-CA 120.031 -1.08 . . . . 0.0 111.721 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.447 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 31.39 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.465 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.0 m -66.1 -53.69 34.92 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.315 -0.866 . . . . 0.0 110.696 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -58.28 -32.78 68.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.587 -0.696 . . . . 0.0 110.169 -179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.496 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.2 OUTLIER -67.03 -36.73 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.892 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 179.038 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 t -59.81 -28.46 67.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.505 -0.747 . . . . 0.0 109.429 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.59 -51.84 60.67 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.6 m -75.12 -71.39 0.36 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.513 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -78.14 96.18 5.11 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 177.681 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -59.92 83.83 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -156.34 174.44 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.251 -0.905 . . . . 0.0 109.484 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.71 141.66 44.47 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.2 ppt_? -70.56 -38.76 74.18 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.076 -178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 p -64.49 -40.78 96.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.995 -1.065 . . . . 0.0 108.814 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.2 m -64.17 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.88 -29.99 44.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.527 ' CD1' ' CD1' ' A' ' 39' ' ' ILE . 2.9 m-85 -72.12 -31.42 66.01 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.976 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -36.79 68.42 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.383 1.087 . . . . 0.0 108.206 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.6 -55.49 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.073 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.677 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 1.1 mt -54.65 -45.01 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 121.93 0.871 . . . . 0.0 109.478 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -60.56 -39.1 86.72 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -64.13 -28.9 70.09 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.274 -0.571 . . . . 0.0 109.626 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.539 -0.725 . . . . 0.0 109.502 179.989 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -64.01 -24.56 67.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.611 -0.681 . . . . 0.0 109.92 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.95 -52.11 65.37 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.359 -0.838 . . . . 0.0 109.71 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.2 t -60.61 -34.83 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.6 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -61.2 -39.06 88.8 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.783 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -66.98 -26.31 66.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.419 -0.801 . . . . 0.0 109.981 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.447 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 3.2 mtm -67.4 -67.08 0.48 Allowed 'General case' 0 C--N 1.306 -1.288 0 O-C-N 121.345 -0.847 . . . . 0.0 111.146 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.586 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 90.0 m95 -66.23 -40.03 89.99 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.087 -1.008 . . . . 0.0 112.081 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.41 ' CG ' ' O ' ' A' ' 12' ' ' LEU . 14.8 mm100 -59.29 -20.83 57.58 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.662 -0.649 . . . . 0.0 110.815 -177.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -89.47 -27.33 20.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.324 -0.86 . . . . 0.0 109.75 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.72 68.84 0.55 Allowed Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.231 -1.548 . . . . 0.0 109.231 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 14' ' ' MET . 0.0 OUTLIER -120.9 162.61 19.55 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.626 -0.926 . . . . 0.0 109.995 -178.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.478 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -136.22 118.92 1.9 Allowed Glycine 0 N--CA 1.5 2.937 0 C-N-CA 120.264 -0.969 . . . . 0.0 111.586 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.452 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 31.22 -85.36 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 179.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 t -67.68 -53.11 30.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.3 -0.875 . . . . 0.0 110.55 -178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 19' ' ' LEU . 7.9 t60 -59.06 -26.49 64.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.595 -0.691 . . . . 0.0 110.551 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.492 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 0.2 OUTLIER -69.92 -36.44 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.889 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 179.402 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -64.41 -40.9 96.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.718 -0.614 . . . . 0.0 110.105 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -60.72 -34.4 74.35 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.475 -0.765 . . . . 0.0 109.926 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.4 m -71.25 -58.49 3.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.517 -0.739 . . . . 0.0 109.947 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 23.9 mmt -104.61 -140.83 0.36 Allowed 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -137.48 88.21 2.32 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.332 -1.48 . . . . 0.0 111.82 -178.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.1 pp -168.29 153.49 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 O-C-N 121.234 -0.916 . . . . 0.0 110.39 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.425 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -71.69 167.04 20.69 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -64.26 -41.47 96.94 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.236 -0.915 . . . . 0.0 111.529 -178.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.04 -30.22 58.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.163 -0.96 . . . . 0.0 108.953 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.3 m -63.93 -34.66 78.47 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.557 ' O ' HD11 ' A' ' 39' ' ' ILE . 2.5 t -63.58 -45.03 98.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.678 ' HA ' HD11 ' A' ' 39' ' ' ILE . 14.4 m-85 -62.94 -16.71 60.27 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 120.156 -0.618 . . . . 0.0 111.498 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.4 -39.1 85.56 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 175.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.3 t -71.49 -60.91 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.034 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' A' ' 36' ' ' TYR . 1.8 mp -55.67 -32.98 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 CA-C-O 121.758 0.79 . . . . 0.0 109.63 -176.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -65.54 -41.68 92.8 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.19 -34.08 76.86 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.714 -0.616 . . . . 0.0 109.476 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.54 -0.725 . . . . 0.0 109.793 179.957 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 120.785 0.326 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.42 -33.93 73.71 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.284 -0.885 . . . . 0.0 109.674 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.11 72.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.558 -0.714 . . . . 0.0 109.773 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.6 t -76.94 -32.34 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -22.74 67.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.469 -0.77 . . . . 0.0 109.427 179.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -83.5 -45.83 13.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.102 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.401 ' O ' ' CG2' ' A' ' 24' ' ' ILE . 24.0 ptp -71.03 -3.82 21.68 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.508 -0.745 . . . . 0.0 111.486 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.579 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 33.5 m95 -120.57 -42.46 2.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.463 -1.398 . . . . 0.0 111.22 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -78.7 0.67 25.75 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.382 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -103.77 22.71 13.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.097 -1.002 . . . . 0.0 110.041 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.59 63.55 2.32 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.465 ' CD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -127.41 160.3 31.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.742 -0.858 . . . . 0.0 110.452 -178.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.426 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.5 125.23 1.41 Allowed Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.01 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.471 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 30.1 -84.41 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.1 t -63.92 -52.03 61.7 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.267 -0.896 . . . . 0.0 111.161 -177.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.465 ' CD2' ' CD1' ' A' ' 19' ' ' LEU . 7.3 t60 -61.49 -30.72 70.79 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.446 -0.783 . . . . 0.0 109.834 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.522 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.2 OUTLIER -77.26 -24.36 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.942 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.778 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.9 t -58.52 -48.32 81.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.966 -1.083 . . . . 0.0 110.319 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.412 ' NZ ' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -73.9 -36.72 64.78 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.531 -179.239 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.0 m -62.12 -69.56 0.24 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.35 -0.843 . . . . 0.0 109.759 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.418 ' CG ' ' O ' ' A' ' 24' ' ' ILE . 1.5 ptt? -80.07 -134.73 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -157.69 45.31 0.35 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.368 -1.458 . . . . 0.0 113.1 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 14.3 pt -154.25 166.6 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.958 178.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.21 162.48 2.64 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 110.404 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.459 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -72.55 -33.88 67.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.757 -0.589 . . . . 0.0 111.645 -178.825 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 12.3 p -74.78 -35.54 62.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.022 -1.048 . . . . 0.0 108.775 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 73.7 m -61.26 -33.22 73.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.42 HG22 ' HA ' ' A' ' 32' ' ' ARG . 0.5 OUTLIER -65.86 -40.89 88.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.605 ' HA ' HD11 ' A' ' 39' ' ' ILE . 12.3 m-85 -67.03 -13.77 62.24 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 119.421 -0.911 . . . . 0.0 110.981 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -69.05 -40.23 78.67 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.16 -1.792 . . . . 0.0 106.16 174.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.87 -56.06 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.282 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.605 HD11 ' HA ' ' A' ' 36' ' ' TYR . 4.2 mt -54.17 -34.12 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.407 -0.808 . . . . 0.0 109.316 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.33 -40.96 73.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -60.98 -30.29 70.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.703 -0.623 . . . . 0.0 109.795 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.494 1.772 0 O-C-N 121.93 -0.482 . . . . 0.0 109.827 -179.929 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptt180 . . . . . 0 N--CA 1.507 2.394 0 CA-C-O 121.229 0.537 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.69 -28.67 61.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.336 -0.852 . . . . 0.0 109.564 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.06 -54.84 5.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.546 -0.721 . . . . 0.0 110.029 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.0 t -58.78 -40.19 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 109.176 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.5 tt -59.2 -39.07 81.48 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -57.44 -33.85 68.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.446 -0.784 . . . . 0.0 109.079 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.466 ' HG3' ' CB ' ' A' ' 28' ' ' MET . 16.3 mmt -62.59 -45.92 90.65 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.827 -0.546 . . . . 0.0 109.655 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.632 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 32.8 m95 -79.54 -0.27 32.73 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.171 -0.955 . . . . 0.0 111.079 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -100.33 -21.5 15.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.962 -1.086 . . . . 0.0 111.321 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -95.62 10.61 36.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.133 -0.98 . . . . 0.0 111.362 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.24 65.58 1.52 Allowed Glycine 0 N--CA 1.496 2.642 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.49 ' HB3' ' CG1' ' A' ' 24' ' ' ILE . 7.4 mp -124.18 -172.59 2.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.668 -0.901 . . . . 0.0 109.309 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -164.62 120.87 0.97 Allowed Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.002 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 17.38 -72.45 0.0 OUTLIER 'General case' 0 N--CA 1.522 3.163 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 20' ' ' GLY . 41.6 m -50.61 -59.98 3.5 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.118 -0.989 . . . . 0.0 110.361 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.44 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 5.9 t60 -65.65 -38.42 89.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.392 -0.818 . . . . 0.0 109.341 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.506 HD12 ' CD2' ' A' ' 15' ' ' TRP . 38.6 mt -72.96 -7.23 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.609 -0.682 . . . . 0.0 110.36 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.417 ' CB ' ' HA ' ' A' ' 30' ' ' ILE . 1.0 OUTLIER -87.21 -68.62 0.74 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.545 -0.722 . . . . 0.0 110.054 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -26.17 41.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.623 -0.673 . . . . 0.0 110.685 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.8 t -85.67 -36.57 20.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.495 -0.753 . . . . 0.0 109.942 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.466 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -141.17 112.89 7.66 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -178.549 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.411 ' O ' ' CG2' ' A' ' 35' ' ' VAL . 4.3 t-20 40.35 90.08 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.707 -0.621 . . . . 0.0 111.862 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.431 HD11 HG22 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -58.02 -162.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.679 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.452 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . 63.38 105.47 0.03 OUTLIER 'General case' 0 C--O 1.193 -1.876 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -57.62 -52.83 63.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.686 -0.634 . . . . 0.0 111.66 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -57.78 -40.98 81.11 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.112 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -67.57 -31.75 72.03 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.952 0.882 . . . . 0.0 108.938 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.452 ' CG2' ' O ' ' A' ' 31' ' ' ALA . 89.1 t -66.69 -31.19 52.4 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.462 ' CE1' HD11 ' A' ' 39' ' ' ILE . 16.2 m-85 -76.25 -23.02 54.46 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.368 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -37.85 84.12 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.3 t -67.94 -52.72 36.35 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.344 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.632 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 4.5 mt -58.43 -36.65 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-O 121.819 0.819 . . . . 0.0 110.052 -176.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -66.05 -36.98 84.71 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -57.15 -21.31 31.8 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.723 -0.611 . . . . 0.0 110.117 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.496 1.843 0 O-C-N 121.349 -0.845 . . . . 0.0 109.949 179.744 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.085 0.469 . . . . 0.0 109.85 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.06 -26.3 66.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.519 -0.738 . . . . 0.0 110.163 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -53.07 59.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.467 -0.771 . . . . 0.0 109.915 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.419 ' HA ' ' CE ' ' A' ' 14' ' ' MET . 45.4 t -59.43 -34.6 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.287 -0.883 . . . . 0.0 109.387 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 16.1 mt -65.27 -33.48 76.07 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -66.56 -31.02 71.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.164 -0.96 . . . . 0.0 110.562 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.42 ' HB3' HG21 ' A' ' 24' ' ' ILE . 16.4 mtm -70.51 -61.04 1.92 Allowed 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.278 -0.889 . . . . 0.0 111.372 -178.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 97.7 m95 -76.33 -42.01 46.49 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.295 -0.878 . . . . 0.0 112.963 -176.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 7.9 mm100 -63.25 -26.42 68.77 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.599 -0.688 . . . . 0.0 110.489 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -78.38 -24.41 46.37 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.311 -0.868 . . . . 0.0 109.807 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.12 63.13 0.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.492 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 8.4 mt -119.51 -173.63 2.56 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.932 . . . . 0.0 110.831 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -145.45 116.51 0.91 Allowed Glycine 0 N--CA 1.498 2.832 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.469 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 10.1 -65.35 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.3 1.592 . . . . 0.0 115.3 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.5 m -45.61 -57.44 4.18 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.07 -1.019 . . . . 0.0 110.826 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.492 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 10.2 t60 -81.52 -31.0 33.0 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.392 -0.818 . . . . 0.0 109.365 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.496 HD11 ' CH2' ' A' ' 15' ' ' TRP . 67.8 mt -61.82 -21.99 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.298 -0.876 . . . . 0.0 110.613 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 p -109.05 -54.45 2.53 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.307 -0.871 . . . . 0.0 110.596 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -24.86 65.1 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.434 -0.791 . . . . 0.0 110.235 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.409 ' OG1' ' CD2' ' A' ' 23' ' ' HIS . 18.4 m -86.4 -57.01 3.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.453 -0.779 . . . . 0.0 109.828 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -101.97 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.402 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 25.7 t-20 -163.58 64.66 0.17 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.551 -1.343 . . . . 0.0 111.039 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 29' ' ' ASN . 0.7 OUTLIER -176.43 -175.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 O-C-N 121.084 -1.01 . . . . 0.0 110.075 179.471 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.42 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -97.83 170.64 8.83 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.415 ' CD ' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -64.4 -46.67 82.26 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 0.0 111.703 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 1.0 OUTLIER -67.88 -36.25 79.92 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.206 -0.934 . . . . 0.0 108.753 -179.605 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.6 m -61.06 -35.23 76.39 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.533 ' CG1' HD13 ' A' ' 39' ' ' ILE . 12.2 t -64.17 -34.22 67.46 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.309 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.61 ' HA ' HD11 ' A' ' 39' ' ' ILE . 13.4 m-85 -75.28 -15.36 60.52 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.397 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.28 -39.42 86.01 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.408 ' CG1' ' CG1' ' A' ' 11' ' ' VAL . 2.1 t -74.47 -55.01 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.237 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.61 HD11 ' HA ' ' A' ' 36' ' ' TYR . 6.3 mt -56.03 -33.28 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.407 -0.808 . . . . 0.0 109.631 -177.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.17 -40.6 82.27 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -63.48 -28.1 69.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.79 -0.569 . . . . 0.0 109.586 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.495 1.805 0 O-C-N 121.441 -0.787 . . . . 0.0 109.584 -179.96 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.83 -29.14 60.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.515 -0.74 . . . . 0.0 109.703 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.15 -59.05 3.52 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.579 -0.701 . . . . 0.0 109.678 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.0 t -60.87 -38.4 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.564 -0.71 . . . . 0.0 109.626 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.9 mt -70.98 -21.72 62.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 110.359 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -71.74 -47.4 54.03 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.999 -1.063 . . . . 0.0 110.709 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.405 ' HB2' HG21 ' A' ' 24' ' ' ILE . 12.7 ptp -73.32 -48.21 36.26 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.295 -0.878 . . . . 0.0 112.339 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.508 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 75.3 m95 -65.57 -49.83 67.36 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.653 -1.279 . . . . 0.0 111.686 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 mm-40 -62.81 -25.8 68.43 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.901 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -71.33 -29.57 65.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.315 -0.866 . . . . 0.0 109.114 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.26 50.84 0.21 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.431 ' CD2' HG21 ' A' ' 24' ' ' ILE . 1.7 mp -112.07 168.96 9.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.589 -0.948 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.457 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -153.67 117.76 0.82 Allowed Glycine 0 N--CA 1.498 2.805 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.851 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.463 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 34.94 -86.6 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -70.96 -51.65 24.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.174 -0.954 . . . . 0.0 110.236 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -57.39 -30.49 64.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.607 -0.683 . . . . 0.0 110.142 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.505 HD12 ' CZ2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -65.43 -39.7 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.752 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.53 -32.42 68.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.703 -0.623 . . . . 0.0 109.84 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -43.78 98.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.573 -0.704 . . . . 0.0 109.162 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.4 m -74.1 -66.58 0.7 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.547 -0.72 . . . . 0.0 109.414 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 3.4 mtm -117.14 109.97 17.59 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -45.35 102.53 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.706 -0.621 . . . . 0.0 112.063 -178.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.7 pt -143.79 159.4 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.64 -0.663 . . . . 0.0 109.9 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.51 150.75 24.46 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 33' ' ' SER . 33.5 ptt180 -77.57 -46.48 22.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.914 -1.116 . . . . 0.0 111.893 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.436 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 47.2 p -71.49 -39.1 71.06 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.18 -0.95 . . . . 0.0 108.577 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.9 m -59.78 -46.84 87.95 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.465 1.126 . . . . 0.0 108.804 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 39' ' ' ILE . 27.3 t -60.08 -38.68 77.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.454 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.8 m-85 -69.01 -18.94 64.11 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.24 -178.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -61.28 -37.58 83.7 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 174.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -49.13 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.818 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.508 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 7.6 mm -57.37 -37.61 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.884 -1.135 . . . . 0.0 110.086 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -68.82 -40.25 79.59 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.18 -14.41 62.26 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.838 -0.539 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.497 1.881 0 O-C-N 121.144 -0.973 . . . . 0.0 109.568 -179.914 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 121.049 0.452 . . . . 0.0 109.99 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.33 -23.95 62.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.413 -0.804 . . . . 0.0 109.88 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.75 -54.31 37.33 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 109.768 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.7 t -58.07 -39.91 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.471 -0.768 . . . . 0.0 109.614 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.6 mt -59.7 -37.75 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.68 -0.637 . . . . 0.0 109.777 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -65.87 -28.13 68.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.59 -0.693 . . . . 0.0 109.968 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' A' ' 28' ' ' MET . 25.4 mmt -63.97 -52.86 57.69 Favored 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.388 -0.82 . . . . 0.0 109.766 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 86.5 m95 -63.93 -31.81 73.12 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.257 -0.902 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -67.58 -18.87 65.15 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.804 -0.56 . . . . 0.0 110.713 -178.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -95.91 14.12 24.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.263 -0.898 . . . . 0.0 110.663 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.28 63.06 2.45 Favored Glycine 0 N--CA 1.495 2.611 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.43 HD13 ' CD2' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -118.43 153.98 33.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.697 -0.884 . . . . 0.0 110.293 -179.224 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.429 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -141.32 121.8 1.95 Allowed Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.349 -0.929 . . . . 0.0 110.961 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.427 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 29.18 -84.78 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.3 m -64.12 -54.14 38.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.334 -0.854 . . . . 0.0 111.097 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.43 ' CD2' HD13 ' A' ' 19' ' ' LEU . 6.6 t60 -60.15 -32.79 71.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.495 ' CD1' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -64.36 -32.68 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.076 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -69.93 -27.71 64.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.661 -0.65 . . . . 0.0 109.496 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -47.61 83.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.283 -0.886 . . . . 0.0 109.031 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -74.16 -64.1 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.561 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -98.98 98.06 9.15 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.017 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -52.15 89.26 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.664 -0.647 . . . . 0.0 112.334 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -151.39 161.99 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.172 -0.955 . . . . 0.0 109.111 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.41 158.83 35.02 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.341 -0.849 . . . . 0.0 109.429 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -42.33 81.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.55 -0.719 . . . . 0.0 111.213 -179.06 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 p -72.46 -32.84 66.58 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.064 -1.022 . . . . 0.0 108.37 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.6 m -62.23 -30.28 70.98 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.429 ' CG1' HD13 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -68.23 -40.54 82.88 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.664 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.746 ' HA ' HD11 ' A' ' 39' ' ' ILE . 20.3 m-85 -67.1 -11.98 58.7 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.762 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -74.58 -39.06 62.48 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.7 -54.38 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.147 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.746 HD11 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mt -55.69 -38.13 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.906 -177.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -66.04 -40.84 91.33 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -61.76 -28.89 69.77 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.708 -0.62 . . . . 0.0 109.754 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.5 -0.75 . . . . 0.0 109.528 -179.897 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -92.76 -73.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.563 -0.963 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.84 43.75 1.62 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.533 -0.729 . . . . 0.0 109.511 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -92.43 -79.65 0.38 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.486 -0.759 . . . . 0.0 109.508 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -114.56 78.38 1.15 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.43 -0.793 . . . . 0.0 109.455 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.6 pp -153.79 147.39 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.456 -0.778 . . . . 0.0 109.575 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.14 170.46 10.61 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.616 -0.677 . . . . 0.0 109.335 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 179.36 -38.62 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.526 -0.734 . . . . 0.0 109.473 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -70.38 -24.6 62.98 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.948 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -67.19 0.42 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.426 -0.796 . . . . 0.0 109.997 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 20.7 t -65.45 -32.39 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.5 -0.75 . . . . 0.0 109.643 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.03 -22.49 64.61 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.588 -0.695 . . . . 0.0 110.374 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -92.86 -44.05 8.68 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.428 ' HG2' ' HB3' ' A' ' 28' ' ' MET . 1.7 mpp? -61.69 -14.1 28.61 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.462 -0.774 . . . . 0.0 111.615 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.548 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 69.0 m95 -113.0 -42.72 3.51 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.725 -1.235 . . . . 0.0 110.869 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -75.64 -3.96 37.48 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.527 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -95.36 -29.3 14.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.089 -1.007 . . . . 0.0 109.519 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.94 75.94 0.42 Allowed Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 14' ' ' MET . 4.9 mp -133.25 -173.43 3.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.483 -1.01 . . . . 0.0 110.031 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.428 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.61 116.97 0.74 Allowed Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.03 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.469 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 29.01 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 22.0 t -61.76 -56.4 19.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 110.667 -178.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -57.92 -27.6 63.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.482 -0.761 . . . . 0.0 110.533 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.497 ' CD1' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -72.45 -39.01 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.806 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.65 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 99.1 p -65.2 -46.32 81.22 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.695 -0.628 . . . . 0.0 110.052 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -28.14 67.21 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.743 . . . . 0.0 109.829 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 m -79.32 -38.46 35.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.528 -0.732 . . . . 0.0 110.361 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.428 ' HB3' ' HG2' ' A' ' 14' ' ' MET . 2.6 ptt? -110.27 -153.22 0.51 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -120.4 46.75 1.91 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.263 -0.898 . . . . 0.0 112.315 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 pt -153.91 148.58 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 120.801 -1.187 . . . . 0.0 110.636 179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.73 174.28 1.08 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.653 -0.654 . . . . 0.0 109.836 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.412 ' HB2' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -75.61 -41.48 54.33 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 111.662 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.411 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 4.9 t -68.93 -37.42 78.89 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.4 m -64.06 -37.3 86.93 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.437 ' O ' HG12 ' A' ' 39' ' ' ILE . 14.4 t -60.37 -41.2 86.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.7 m-85 -70.25 -18.42 63.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.973 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -59.98 -36.63 77.55 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 174.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.4 t -72.82 -57.44 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.449 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.548 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 6.0 mm -52.98 -31.35 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.837 0.827 . . . . 0.0 110.61 -176.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -74.34 -41.0 61.79 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -60.65 -33.31 72.63 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.709 -0.619 . . . . 0.0 109.796 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.8 m 59.57 29.8 19.39 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.49 -0.756 . . . . 0.0 109.725 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.491 179.997 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -90.76 -172.69 3.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.969 . . . . 0.0 109.488 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -84.6 90.61 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.68 . . . . 0.0 109.502 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -118.42 36.32 4.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.575 -0.703 . . . . 0.0 109.448 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.0 mtmt -99.73 -65.56 0.96 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.565 -0.71 . . . . 0.0 109.504 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.459 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.7 mp -88.16 74.43 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.35 79.65 1.4 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -97.48 32.94 2.12 Favored 'General case' 0 N--CA 1.483 1.194 0 O-C-N 121.607 -0.683 . . . . 0.0 109.709 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -22.67 65.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.559 -0.713 . . . . 0.0 109.976 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.94 -50.86 30.03 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.408 -0.807 . . . . 0.0 109.769 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.8 t -60.65 -44.65 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.504 -0.747 . . . . 0.0 109.429 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.8 tp -63.55 -30.97 72.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.779 -0.576 . . . . 0.0 109.786 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -66.26 -30.71 71.2 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.377 -0.827 . . . . 0.0 110.142 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.449 ' HG3' ' CB ' ' A' ' 28' ' ' MET . 6.6 mmt -70.89 -56.48 6.18 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 121.429 -0.794 . . . . 0.0 110.285 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.569 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 98.3 m95 -58.86 -40.03 83.12 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.318 -0.864 . . . . 0.0 111.494 -178.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -67.95 -16.31 64.0 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.823 -0.548 . . . . 0.0 111.891 -176.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -94.82 22.04 6.86 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.161 -0.962 . . . . 0.0 110.773 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.95 54.08 7.42 Favored Glycine 0 N--CA 1.5 2.939 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.522 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 8.5 mp -122.91 -170.8 2.17 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.924 . . . . 0.0 108.938 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.502 ' N ' HG12 ' A' ' 24' ' ' ILE . . . 178.39 116.13 0.48 Allowed Glycine 0 N--CA 1.499 2.864 0 C-N-CA 119.376 -1.392 . . . . 0.0 112.899 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 32.55 -78.98 0.0 OUTLIER 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 20' ' ' GLY . 29.6 t -44.16 -42.51 6.45 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.522 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 7.2 t60 -94.57 -29.47 14.87 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 177.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.502 HG12 ' N ' ' A' ' 20' ' ' GLY . 16.6 mm -76.19 8.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 121.217 -0.927 . . . . 0.0 110.762 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.7 m -137.4 -35.13 0.68 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.052 -1.03 . . . . 0.0 111.05 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.36 -36.22 16.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.833 -1.167 . . . . 0.0 110.305 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 32.2 m -91.39 -28.84 17.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.42 -0.8 . . . . 0.0 111.301 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.449 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -101.01 34.18 2.59 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.232 -0.917 . . . . 0.0 109.402 -178.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 33.95 58.64 0.59 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.404 ' CD1' ' CG2' ' A' ' 35' ' ' VAL . 6.0 pt -157.79 172.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.524 -0.735 . . . . 0.0 109.054 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.418 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -96.69 156.4 16.36 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.2 ptp180 -78.0 -45.93 22.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.848 -1.158 . . . . 0.0 111.53 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -63.99 -42.25 97.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.11 -0.994 . . . . 0.0 108.943 -179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.2 m -63.68 -44.84 92.55 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 122.574 1.178 . . . . 0.0 108.236 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.492 ' CG1' HD12 ' A' ' 39' ' ' ILE . 12.0 t -63.4 -21.5 28.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.679 ' HA ' HD13 ' A' ' 39' ' ' ILE . 2.1 m-85 -79.08 -24.54 43.43 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.21 -0.931 . . . . 0.0 110.137 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 mtpt -61.96 -37.45 84.8 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.86 -54.28 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.997 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.679 HD13 ' HA ' ' A' ' 36' ' ' TYR . 12.2 mt -53.99 -30.74 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 O-C-N 121.449 -0.782 . . . . 0.0 110.077 -178.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -72.69 -41.19 65.56 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.97 22.58 7.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.773 -0.579 . . . . 0.0 109.863 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.6 t -118.79 -39.58 2.95 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 109.423 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.448 -179.959 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -65.97 135.6 54.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.578 -0.954 . . . . 0.0 109.513 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.66 95.97 8.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.563 -0.71 . . . . 0.0 109.367 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.35 71.79 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.532 -0.73 . . . . 0.0 109.534 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -60.33 -27.31 67.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.342 -0.849 . . . . 0.0 109.953 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.469 HD11 HG22 ' A' ' 6' ' ' ILE . 52.2 mt -61.41 165.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.558 -0.714 . . . . 0.0 109.59 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.403 ' N ' ' CG2' ' A' ' 6' ' ' ILE . 3.9 t70 -85.7 101.75 13.02 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -160.21 44.48 0.21 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.13 -23.33 62.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.626 -0.671 . . . . 0.0 109.972 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.34 -55.74 25.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.388 -0.82 . . . . 0.0 109.731 -179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.8 t -66.89 -42.1 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.493 -0.755 . . . . 0.0 109.285 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -26.45 61.85 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.567 -0.708 . . . . 0.0 109.946 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -86.8 -32.64 20.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.367 -0.833 . . . . 0.0 109.357 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.413 ' HB3' HG21 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -82.64 5.11 22.19 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.623 -0.673 . . . . 0.0 111.141 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.582 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 10.1 m95 -128.24 -49.47 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.386 1.089 . . . . 0.0 109.691 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.06 -15.25 61.51 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.008 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -80.16 -27.68 38.94 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.191 -0.943 . . . . 0.0 109.48 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.77 65.85 0.26 Allowed Glycine 0 N--CA 1.496 2.64 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.448 ' CB ' HG12 ' A' ' 24' ' ' ILE . 4.9 mp -127.98 -171.74 2.52 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.497 -1.002 . . . . 0.0 110.158 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.439 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -154.55 112.21 0.52 Allowed Glycine 0 N--CA 1.496 2.677 0 C-N-CA 119.647 -1.263 . . . . 0.0 111.777 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 16.25 -74.31 0.0 OUTLIER 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.4 p -48.65 -59.35 3.59 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.179 -0.951 . . . . 0.0 110.776 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.417 ' CD2' HD22 ' A' ' 19' ' ' LEU . 6.1 t60 -64.93 -37.51 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.537 ' CD1' ' CZ3' ' A' ' 15' ' ' TRP . 78.8 mt -66.73 -14.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.813 -0.554 . . . . 0.0 110.283 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 p -81.18 -40.79 23.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 108.789 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -55.33 16.84 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 t -62.64 -48.24 80.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.638 -0.664 . . . . 0.0 109.461 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.424 ' HB3' ' O ' ' A' ' 24' ' ' ILE . 0.0 OUTLIER -107.44 93.57 4.62 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 178.506 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -47.94 96.36 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.2 pt -172.01 147.95 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 177.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.419 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -61.27 155.92 19.92 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.438 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.4 OUTLIER -64.31 -35.2 80.08 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.185 -0.947 . . . . 0.0 111.244 -178.361 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.438 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 86.9 p -75.42 -36.73 60.73 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.144 -0.973 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.7 m -61.8 -34.96 76.85 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.512 ' CG1' HD13 ' A' ' 39' ' ' ILE . 8.9 t -66.08 -34.79 72.61 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.39 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.652 ' HA ' HD11 ' A' ' 39' ' ' ILE . 16.1 m-85 -75.25 -13.3 60.43 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.85 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -68.98 -38.4 79.3 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 174.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -76.7 -54.38 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.094 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.652 HD11 ' HA ' ' A' ' 36' ' ' TYR . 5.6 mt -56.07 -34.26 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.414 -0.804 . . . . 0.0 109.563 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -69.79 -40.71 75.85 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -59.94 -28.75 67.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.923 -0.485 . . . . 0.0 109.773 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.2 m -68.28 -58.64 4.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.53 -0.731 . . . . 0.0 109.346 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.495 179.987 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -58.76 -22.69 58.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.488 -1.007 . . . . 0.0 110.404 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -73.61 -35.99 65.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.404 -0.81 . . . . 0.0 109.501 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.14 179.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.588 -0.695 . . . . 0.0 109.401 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.15 138.85 57.41 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.528 -0.733 . . . . 0.0 110.059 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.4 pp -136.54 -174.74 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.546 -0.721 . . . . 0.0 109.547 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -54.34 159.93 1.83 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.402 -0.811 . . . . 0.0 110.638 -179.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.87 26.57 13.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.556 -0.715 . . . . 0.0 110.042 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -62.27 -31.05 71.57 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.521 -0.737 . . . . 0.0 109.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.53 -42.04 98.45 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.585 -0.697 . . . . 0.0 109.881 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.6 -49.28 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.529 -0.732 . . . . 0.0 109.076 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.65 -8.71 57.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.733 -0.604 . . . . 0.0 110.486 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -38.03 48.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.866 -1.147 . . . . 0.0 109.748 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.465 ' HB3' HG21 ' A' ' 24' ' ' ILE . 15.9 mmt -83.66 -45.26 13.64 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.495 -0.753 . . . . 0.0 110.45 -179.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.575 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 35.0 m95 -55.14 -51.24 67.08 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.924 -1.11 . . . . 0.0 110.14 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -63.68 -28.27 69.79 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.472 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -73.89 -29.31 62.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.281 -0.887 . . . . 0.0 109.318 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.94 65.32 0.23 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.446 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 0.6 OUTLIER -133.47 160.56 37.05 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.446 -1.032 . . . . 0.0 109.963 -179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.46 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -138.59 121.91 2.26 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.484 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.42 ' N ' ' CD1' ' A' ' 24' ' ' ILE . . . 28.45 -83.4 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.5 t -64.43 -56.35 14.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.411 -0.806 . . . . 0.0 111.235 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.446 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 82.1 t60 -57.04 -30.03 63.9 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.369 -0.832 . . . . 0.0 110.21 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.559 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -74.49 -34.61 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.7 p -62.78 -34.58 77.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.634 -0.666 . . . . 0.0 109.331 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -34.83 78.8 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.407 ' O ' ' CE ' ' A' ' 28' ' ' MET . 2.2 m -88.89 -76.42 0.4 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.823 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.491 ' HA ' ' HE3' ' A' ' 28' ' ' MET . 19.1 mmt -155.79 82.78 1.02 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.282 -0.886 . . . . 0.0 110.032 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.501 ' O ' ' O ' ' A' ' 30' ' ' ILE . 1.6 t-20 -152.74 -41.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.726 -1.234 . . . . 0.0 112.756 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.501 ' O ' ' O ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER 50.75 145.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.915 0 CA-C-O 121.834 0.826 . . . . 0.0 112.359 -177.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.402 ' O ' ' O ' ' A' ' 30' ' ' ILE . . . 40.03 97.27 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.684 -0.635 . . . . 0.0 111.248 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.402 ' CD ' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -68.61 -42.53 77.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.969 -1.082 . . . . 0.0 112.535 -177.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 70.8 m -63.72 -43.9 95.18 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.045 -1.035 . . . . 0.0 108.845 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -63.1 -36.22 82.86 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.176 0.988 . . . . 0.0 108.617 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.47 ' CG1' HD12 ' A' ' 39' ' ' ILE . 38.0 t -65.2 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.674 ' HA ' HD13 ' A' ' 39' ' ' ILE . 4.6 m-85 -75.48 -21.0 58.43 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -64.18 -36.23 83.39 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 175.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 t -74.41 -56.12 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.162 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.674 HD13 ' HA ' ' A' ' 36' ' ' TYR . 5.7 mt -55.53 -32.49 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.356 -0.84 . . . . 0.0 109.828 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -69.75 -40.4 76.15 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -62.73 -30.26 71.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.769 -0.582 . . . . 0.0 109.569 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.1 t -95.76 82.59 3.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.626 -0.671 . . . . 0.0 109.437 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.474 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -58.83 165.0 2.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.533 -0.981 . . . . 0.0 110.12 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -62.57 128.44 36.01 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.584 -0.697 . . . . 0.0 109.664 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -107.15 -77.85 0.59 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.615 -0.678 . . . . 0.0 109.304 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.46 168.3 19.52 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.319 -0.863 . . . . 0.0 109.828 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm 60.34 105.97 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.58 -0.7 . . . . 0.0 109.875 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -86.76 151.0 23.76 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.522 -0.736 . . . . 0.0 109.297 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -57.92 -37.62 74.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.487 -0.758 . . . . 0.0 109.986 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.17 -33.96 75.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.586 -0.696 . . . . 0.0 109.424 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.86 70.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.595 -0.69 . . . . 0.0 109.425 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.35 -50.69 71.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.01 -23.81 67.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.669 -0.644 . . . . 0.0 109.718 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -63.28 -45.32 91.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.169 -0.957 . . . . 0.0 109.698 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.447 ' HB3' HD13 ' A' ' 19' ' ' LEU . 9.6 mmt -64.27 -43.11 95.84 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.463 -0.773 . . . . 0.0 110.025 -179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.564 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 80.0 m95 -67.78 -25.02 65.4 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.003 -1.061 . . . . 0.0 112.184 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -97.1 13.12 30.27 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.535 -0.728 . . . . 0.0 112.476 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -105.85 -22.25 12.97 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.073 -1.017 . . . . 0.0 110.562 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.44 -49.68 0.81 Allowed Glycine 0 N--CA 1.498 2.785 0 N-CA-C 108.42 -1.872 . . . . 0.0 108.42 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.468 ' CD1' ' CD2' ' A' ' 23' ' ' HIS . 0.2 OUTLIER -48.47 173.78 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 122.015 -0.697 . . . . 0.0 110.979 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.472 ' CA ' HG12 ' A' ' 24' ' ' ILE . . . -167.45 135.64 3.75 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.954 -1.117 . . . . 0.0 111.503 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 36.68 -83.41 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.442 ' N ' ' O ' ' A' ' 20' ' ' GLY . 2.9 m -47.99 -52.26 20.51 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.383 -0.823 . . . . 0.0 109.468 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.468 ' CD2' ' CD1' ' A' ' 19' ' ' LEU . 4.9 t60 -78.77 -31.65 46.22 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 177.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.472 HG12 ' CA ' ' A' ' 20' ' ' GLY . 19.1 mm -71.7 1.73 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.284 -0.885 . . . . 0.0 110.525 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 t -110.64 -67.02 1.02 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.835 -1.165 . . . . 0.0 110.031 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -26.43 68.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.614 -0.679 . . . . 0.0 110.555 -178.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 m -90.89 -37.33 13.63 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.35 -0.844 . . . . 0.0 111.424 -178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.414 ' CE ' HG12 ' A' ' 35' ' ' VAL . 48.9 ttp -91.5 -80.12 0.36 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.138 -0.976 . . . . 0.0 109.972 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -137.25 -61.35 0.65 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.017 -1.052 . . . . 0.0 113.079 -177.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.4 pp -155.0 -177.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.987 -1.07 . . . . 0.0 112.279 -176.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -34.92 142.14 0.05 Allowed 'General case' 0 N--CA 1.505 2.295 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.34 -179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt180 -65.76 -22.2 66.57 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.92 -0.487 . . . . 0.0 111.895 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.1 t -64.22 -50.63 67.26 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.9 m -63.92 -38.93 92.9 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.487 1.137 . . . . 0.0 107.975 178.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.505 ' CG1' HD13 ' A' ' 39' ' ' ILE . 39.7 t -61.69 -26.35 39.47 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.446 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.627 ' HA ' HD11 ' A' ' 39' ' ' ILE . 6.5 m-85 -78.59 -23.99 45.68 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.569 -0.707 . . . . 0.0 110.395 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -38.27 83.54 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -76.5 -53.61 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.421 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 36' ' ' TYR . 14.8 mt -53.35 -30.76 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.425 -0.797 . . . . 0.0 110.183 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.5 -42.49 52.71 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -61.49 -23.28 65.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.846 -0.534 . . . . 0.0 110.009 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 73.06 -82.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.572 -0.705 . . . . 0.0 109.692 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.7 p30 . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 117.892 -1.052 . . . . 0.0 109.498 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -91.17 -41.33 11.06 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.566 -0.961 . . . . 0.0 109.423 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.3 mmmt -75.51 150.8 38.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.581 -0.7 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.53 31.55 3.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.585 -0.697 . . . . 0.0 109.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.4 tttt -102.43 -67.55 0.87 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.559 -0.713 . . . . 0.0 109.501 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 41.4 mm -93.42 89.81 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.575 -0.703 . . . . 0.0 109.469 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -105.78 137.1 44.22 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.591 -0.693 . . . . 0.0 109.581 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.0 31.59 0.3 Allowed 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -82.06 -20.13 38.88 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.583 -0.698 . . . . 0.0 110.226 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.41 67.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.0 109.805 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.48 -53.35 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.538 -0.726 . . . . 0.0 109.611 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.23 -40.33 70.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.603 -0.686 . . . . 0.0 110.742 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -76.86 -40.87 46.15 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.663 -0.648 . . . . 0.0 111.991 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.419 ' O ' ' CG2' ' A' ' 24' ' ' ILE . 0.0 OUTLIER -85.1 10.11 13.0 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.071 -1.018 . . . . 0.0 111.632 -178.177 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.56 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 6.4 m95 -121.52 -53.1 2.01 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.842 -1.161 . . . . 0.0 109.9 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -76.79 -16.84 59.34 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.157 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -74.21 -27.22 60.69 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.205 -0.934 . . . . 0.0 109.104 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 128.49 66.93 0.12 Allowed Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.462 HD11 ' CD2' ' A' ' 23' ' ' HIS . 2.6 mm? -126.02 -173.43 2.85 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.46 -1.023 . . . . 0.0 110.645 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -170.24 112.79 0.48 Allowed Glycine 0 N--CA 1.49 2.26 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 27.32 -83.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.8 m -60.61 -56.57 19.78 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.3 -0.875 . . . . 0.0 110.791 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.462 ' CD2' HD11 ' A' ' 19' ' ' LEU . 7.4 t60 -58.02 -30.51 66.17 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.526 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -67.97 -36.36 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.772 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.8 t -59.66 -29.94 68.41 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.475 -0.765 . . . . 0.0 109.285 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.36 -52.07 50.7 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.595 -0.691 . . . . 0.0 109.142 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 54.6 m -74.23 -72.3 0.29 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 1.9 ttm -80.93 99.01 8.15 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -57.57 88.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.958 -0.464 . . . . 0.0 111.076 -178.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -160.51 160.97 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 O-C-N 121.463 -0.773 . . . . 0.0 110.04 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.59 151.53 47.16 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.414 ' HB2' ' CB ' ' A' ' 21' ' ' ALA . 5.1 ptt-85 -75.44 -43.36 50.11 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.358 -0.839 . . . . 0.0 111.459 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.404 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -63.82 -43.17 97.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 109.183 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.3 m -57.73 -43.37 85.26 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.711 1.243 . . . . 0.0 108.323 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.471 ' O ' HG12 ' A' ' 39' ' ' ILE . 3.2 t -58.93 -37.43 67.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.481 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 4.1 m-85 -71.02 -22.33 62.16 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.478 -0.889 . . . . 0.0 111.43 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mppp? -59.12 -36.36 75.05 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 175.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -71.74 -55.52 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.419 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.56 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 7.4 mm -53.36 -31.84 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.255 0 CA-C-O 121.842 0.83 . . . . 0.0 110.622 -176.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -71.83 -41.93 67.59 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -91.38 16.67 9.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.709 -0.619 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.0 m -166.13 76.85 0.23 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 109.427 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.437 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -59.29 114.4 2.63 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.504 -0.998 . . . . 0.0 109.991 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -59.82 -170.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.526 -0.734 . . . . 0.0 109.977 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -104.32 144.96 30.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.555 -0.716 . . . . 0.0 109.462 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -60.2 166.67 2.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.527 -0.733 . . . . 0.0 109.995 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -96.84 97.59 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.595 -0.691 . . . . 0.0 109.317 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -104.42 53.32 0.74 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.567 -0.708 . . . . 0.0 109.474 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 61.05 68.23 0.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.344 -0.848 . . . . 0.0 109.459 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -69.23 -23.22 63.85 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.524 -0.735 . . . . 0.0 109.828 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.44 -61.7 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.461 -0.775 . . . . 0.0 109.695 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.5 t -57.99 -34.17 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.468 -0.77 . . . . 0.0 109.762 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.7 mp -67.03 -35.52 80.06 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -65.09 -27.82 69.03 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.458 ' O ' ' HB2' ' A' ' 19' ' ' LEU . 45.1 mtt -69.36 -65.87 0.66 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.472 -0.767 . . . . 0.0 110.38 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 88.7 m95 -68.88 -16.09 63.67 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.442 -0.786 . . . . 0.0 112.861 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -93.08 -0.93 56.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 112.275 -177.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -111.03 22.24 15.51 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.998 -1.064 . . . . 0.0 110.751 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.01 55.5 5.77 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.505 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 8.6 mp -123.61 -168.68 1.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.546 -0.973 . . . . 0.0 109.261 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -177.94 116.47 0.54 Allowed Glycine 0 N--CA 1.497 2.756 0 C-N-CA 119.701 -1.238 . . . . 0.0 112.175 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 30.6 -79.33 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.976 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 178.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -45.62 -54.6 7.46 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.485 -0.759 . . . . 0.0 109.435 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.505 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 6.8 t60 -76.64 -32.64 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.482 HG22 ' CE2' ' A' ' 15' ' ' TRP . 16.9 mm -70.67 0.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 121.428 -0.795 . . . . 0.0 110.676 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.408 ' CB ' ' N ' ' A' ' 32' ' ' ARG . 51.9 p -138.19 -0.27 2.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.976 -1.077 . . . . 0.0 111.958 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.412 ' HD2' ' N ' ' A' ' 27' ' ' THR . 0.1 OUTLIER -117.3 -39.7 3.16 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 120.891 -1.131 . . . . 0.0 108.312 -179.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.412 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 59.9 m -90.53 -27.43 19.18 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.607 -0.683 . . . . 0.0 109.182 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.436 ' HG3' ' CG ' ' A' ' 14' ' ' MET . 4.0 mmm -81.38 -125.79 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -143.26 26.67 1.63 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 121.265 1.848 . . . . 0.0 113.364 -178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.465 HD11 HG22 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -156.49 -177.16 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.676 -1.265 . . . . 0.0 110.952 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.415 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -87.71 152.57 22.04 Favored 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.408 ' N ' ' CB ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -63.85 -39.9 95.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.188 -0.945 . . . . 0.0 112.178 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.6 t -61.7 -44.37 97.07 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.187 -0.946 . . . . 0.0 109.084 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.7 m -62.69 -35.65 80.4 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 122.121 0.962 . . . . 0.0 108.583 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.506 ' CG1' HD13 ' A' ' 39' ' ' ILE . 43.9 t -63.99 -30.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.662 ' HA ' HD11 ' A' ' 39' ' ' ILE . 7.1 m-85 -75.99 -20.35 57.93 Favored 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 119.81 -0.756 . . . . 0.0 110.413 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -63.18 -37.37 86.97 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.82 -54.13 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.605 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.662 HD11 ' HA ' ' A' ' 36' ' ' TYR . 6.8 mt -55.03 -33.02 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.306 -0.871 . . . . 0.0 109.838 -177.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.45 -39.71 62.37 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -97.94 23.65 7.82 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.906 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.4 m -149.88 88.35 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.45 -0.781 . . . . 0.0 109.49 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 117.931 -1.033 . . . . 0.0 109.512 179.953 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -64.29 -71.47 0.18 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.531 -0.981 . . . . 0.0 109.485 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -112.15 146.98 37.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.647 -0.658 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -22.55 52.35 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 110.358 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -86.49 155.0 20.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.4 -0.813 . . . . 0.0 109.428 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.8 pp -144.22 111.61 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.601 -0.687 . . . . 0.0 109.595 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -113.08 96.34 5.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.542 -0.724 . . . . 0.0 109.449 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 61.51 63.29 1.2 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.528 -0.732 . . . . 0.0 109.492 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.68 -30.86 71.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 109.325 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.9 -53.18 58.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.582 -0.699 . . . . 0.0 109.303 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 32.4 t -61.01 -30.9 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.555 -0.716 . . . . 0.0 109.557 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 6.7 tp -58.98 -35.69 73.63 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.703 -0.623 . . . . 0.0 109.64 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -85.82 -16.6 38.2 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.521 -0.737 . . . . 0.0 110.465 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.459 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -67.3 -48.71 66.82 Favored 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.363 -0.836 . . . . 0.0 110.846 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.566 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 92.6 m95 -102.41 -30.86 10.77 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.557 -1.339 . . . . 0.0 112.315 -178.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.6 mm-40 -71.34 -22.43 61.91 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -177.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.27 -32.37 38.23 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.332 -0.855 . . . . 0.0 109.098 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.77 63.97 0.43 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 2.5 mp -122.47 -178.94 4.04 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.41 -1.053 . . . . 0.0 109.98 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -152.09 118.62 0.91 Allowed Glycine 0 N--CA 1.496 2.691 0 C-N-CA 119.974 -1.107 . . . . 0.0 111.515 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.484 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 32.99 -86.02 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t -67.1 -52.13 45.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.263 -0.898 . . . . 0.0 110.577 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.462 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 82.8 t60 -58.87 -38.92 79.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.534 -0.729 . . . . 0.0 110.04 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.498 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -57.29 -35.3 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.582 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -68.53 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.114 0.483 . . . . 0.0 109.848 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -27.61 65.1 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 46.1 m -90.43 -67.22 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.466 -0.771 . . . . 0.0 111.162 -179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -92.82 23.87 3.93 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.209 -0.932 . . . . 0.0 111.597 -178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 36.48 84.37 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 177.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -160.25 145.7 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.366 -0.833 . . . . 0.0 109.585 179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.3 149.31 33.88 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.208 -0.933 . . . . 0.0 109.102 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' A' ' 33' ' ' SER . 35.0 ptt180 -74.26 -41.15 61.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.244 -0.91 . . . . 0.0 111.948 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -67.14 -44.1 80.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 108.544 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.9 m -59.4 -40.08 85.45 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.8 1.286 . . . . 0.0 107.992 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.512 ' O ' HD11 ' A' ' 39' ' ' ILE . 5.8 t -60.09 -37.26 72.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.648 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.636 ' HA ' HD11 ' A' ' 39' ' ' ILE . 4.7 m-85 -67.64 -23.27 65.32 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.997 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -62.96 -35.35 79.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -69.87 -60.57 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.664 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.636 HD11 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mp -54.99 -31.56 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 CA-C-O 121.718 0.77 . . . . 0.0 109.939 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -67.07 -42.64 84.35 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -100.67 25.22 8.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.731 -0.605 . . . . 0.0 109.701 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.2 t -80.26 -37.64 32.49 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.471 -0.768 . . . . 0.0 109.577 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 117.98 -1.009 . . . . 0.0 109.63 -179.969 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -98.9 38.52 1.37 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.99 . . . . 0.0 109.486 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -98.21 149.61 22.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.588 -0.695 . . . . 0.0 109.523 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.16 51.14 0.93 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.553 -0.717 . . . . 0.0 109.382 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.66 30.5 3.26 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.557 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 pp -149.87 114.42 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.504 -0.747 . . . . 0.0 109.471 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -113.6 50.34 0.92 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.587 -0.696 . . . . 0.0 109.52 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -61.97 -29.9 70.56 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.447 -0.783 . . . . 0.0 109.748 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -70.23 -29.11 65.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.536 -0.727 . . . . 0.0 109.811 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.02 -46.57 87.88 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.418 -0.801 . . . . 0.0 109.833 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.414 HG11 ' CD1' ' A' ' 15' ' ' TRP . 38.3 t -62.48 -48.53 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 109.052 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.56 -15.9 59.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.72 -0.612 . . . . 0.0 110.503 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -77.46 -43.52 32.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.924 -1.11 . . . . 0.0 110.409 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.423 ' HA ' HD11 ' A' ' 19' ' ' LEU . 27.0 mmt -77.99 -48.75 15.51 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.341 -0.85 . . . . 0.0 111.093 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.53 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 83.5 m95 -63.69 -47.4 81.31 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.821 -1.175 . . . . 0.0 111.491 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -67.81 -36.55 80.61 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.88 -0.513 . . . . 0.0 110.854 -177.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -63.05 -24.0 67.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.278 -0.889 . . . . 0.0 109.944 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.47 62.45 0.57 Allowed Glycine 0 N--CA 1.496 2.662 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.46 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 2.1 mp -130.72 -172.98 2.95 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.648 -0.913 . . . . 0.0 110.063 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -140.93 129.4 4.08 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . -15.27 -44.86 0.0 OUTLIER 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 124.837 1.255 . . . . 0.0 114.021 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.3 m -48.84 -74.03 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.282 -0.886 . . . . 0.0 109.81 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.46 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 1.3 p-80 -85.98 2.64 45.47 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 121.271 -0.893 . . . . 0.0 111.332 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.507 ' CD1' ' CE3' ' A' ' 15' ' ' TRP . 20.6 mt -75.3 -37.29 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 177.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -91.6 -26.95 18.46 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -42.44 82.83 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.371 -0.831 . . . . 0.0 109.007 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.3 m -79.39 -45.34 19.7 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.33 110.46 22.22 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -37.96 89.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.1 pt -179.46 176.2 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -98.8 162.66 12.98 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.307 -0.87 . . . . 0.0 109.13 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 33' ' ' SER . 28.4 ptt180 -77.5 -38.3 49.29 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.2 -0.937 . . . . 0.0 110.607 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -73.7 -39.45 64.34 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.1 m -61.07 -39.69 90.86 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.596 1.189 . . . . 0.0 107.829 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 39' ' ' ILE . 14.0 t -61.01 -41.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 5.1 m-85 -68.4 -19.76 64.63 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.845 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -59.76 -37.37 78.84 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.38 -56.65 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.325 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.53 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 7.5 mm -52.21 -31.47 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 CA-C-O 121.796 0.808 . . . . 0.0 110.581 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -74.07 -41.82 61.13 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -96.7 23.51 6.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.795 -0.566 . . . . 0.0 109.851 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -85.94 -31.36 22.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.435 -0.791 . . . . 0.0 109.451 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.501 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.52 -163.98 0.9 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.586 -0.95 . . . . 0.0 109.325 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -94.1 46.47 1.17 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.555 -0.716 . . . . 0.0 109.419 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 30.7 mtt180 -107.87 156.84 18.72 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.46 -0.775 . . . . 0.0 109.494 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.81 121.57 45.53 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.611 -0.68 . . . . 0.0 109.492 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.7 mm -121.97 84.02 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.554 -0.717 . . . . 0.0 109.453 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.12 171.31 7.42 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.56 -0.713 . . . . 0.0 109.463 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 73.29 -80.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.8 -0.563 . . . . 0.0 110.256 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.92 -23.8 61.7 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.955 -1.091 . . . . 0.0 110.154 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -47.5 76.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.8 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.52 -57.89 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.2 tt -53.4 -23.23 9.2 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.827 -0.546 . . . . 0.0 110.952 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -72.59 -40.01 66.92 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.395 -0.816 . . . . 0.0 110.396 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.44 ' HG3' ' CB ' ' A' ' 28' ' ' MET . 11.4 mmt -67.72 -45.43 75.05 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.433 -0.792 . . . . 0.0 111.682 -178.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.609 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 62.9 m95 -70.61 -27.57 64.18 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.121 -0.987 . . . . 0.0 110.577 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -81.83 -18.66 43.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.483 -0.761 . . . . 0.0 110.432 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -85.09 -31.43 23.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.0 109.681 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.24 -0.61 7.05 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.456 ' HG ' ' CD2' ' A' ' 23' ' ' HIS . 0.4 OUTLIER -62.42 -176.48 0.11 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.111 -1.229 . . . . 0.0 109.906 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -155.24 121.5 1.11 Allowed Glycine 0 N--CA 1.494 2.526 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.262 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 20.57 -80.46 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.412 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.3 t -44.45 -59.91 2.2 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.535 -0.728 . . . . 0.0 111.089 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.456 ' CD2' ' HG ' ' A' ' 19' ' ' LEU . 5.9 t60 -67.38 -40.07 85.69 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.451 -0.781 . . . . 0.0 109.251 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.499 HD12 ' CD2' ' A' ' 15' ' ' TRP . 62.8 mt -69.12 -7.91 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.517 -0.739 . . . . 0.0 111.045 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.1 m -113.92 -71.78 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.477 -0.764 . . . . 0.0 111.266 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -38.72 73.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.851 -1.155 . . . . 0.0 110.29 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.405 ' CG2' ' HE1' ' A' ' 28' ' ' MET . 13.0 m -93.16 -27.17 17.06 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.963 -0.695 . . . . 0.0 111.969 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.44 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 13.8 mmt -118.08 -42.71 2.79 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.058 -1.026 . . . . 0.0 112.049 -177.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.427 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 7.6 m-80 -119.52 -93.5 0.52 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.887 -1.133 . . . . 0.0 111.473 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.427 ' CG2' ' O ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 175.2 114.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 O-C-N 121.135 -0.978 . . . . 0.0 109.438 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . 61.58 143.63 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.395 -0.816 . . . . 0.0 110.042 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.4 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.4 OUTLIER -82.61 -45.85 14.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.067 -1.021 . . . . 0.0 111.873 -178.441 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.4 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 59.4 p -62.41 -42.42 99.43 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.126 -0.983 . . . . 0.0 108.526 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.2 m -63.43 -49.68 72.79 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 39' ' ' ILE . 2.7 t -56.92 -22.08 15.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.368 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.46 ' CE1' HD11 ' A' ' 39' ' ' ILE . 1.1 m-85 -75.79 -36.33 59.81 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.897 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -55.39 -36.34 66.29 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -50.23 77.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.824 179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.609 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 5.0 mt -57.4 -38.36 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-O 121.537 0.684 . . . . 0.0 109.946 -177.058 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.49 -39.15 92.55 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -63.35 -29.55 70.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.823 -0.548 . . . . 0.0 109.642 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.1 m -118.37 27.46 8.94 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.563 -0.711 . . . . 0.0 109.797 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 117.985 -1.007 . . . . 0.0 109.815 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -92.34 127.36 37.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.639 -0.918 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -120.76 80.13 1.59 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.589 -0.695 . . . . 0.0 109.398 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.83 92.08 2.49 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.59 -0.694 . . . . 0.0 109.392 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 156.81 17.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.568 -0.707 . . . . 0.0 109.551 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.5 mt 59.89 175.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.576 -0.702 . . . . 0.0 109.137 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -125.27 46.78 2.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.416 -0.803 . . . . 0.0 109.62 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -70.42 -77.62 0.08 Allowed 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.569 -0.707 . . . . 0.0 109.676 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -63.43 -24.8 67.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.496 -0.752 . . . . 0.0 109.86 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -44.82 95.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.43 -0.793 . . . . 0.0 109.827 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 87.0 t -62.8 -50.27 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.341 -0.849 . . . . 0.0 108.998 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.6 tt -56.36 -29.42 61.37 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.896 -0.502 . . . . 0.0 110.678 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -70.34 -33.83 71.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.455 -0.778 . . . . 0.0 110.098 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.513 ' HG3' ' HB2' ' A' ' 28' ' ' MET . 30.7 mmt -65.3 -47.98 74.71 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.561 -0.712 . . . . 0.0 110.007 -179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.677 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 78.9 m95 -62.42 -33.2 74.32 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.11 -0.994 . . . . 0.0 110.177 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -63.35 -22.19 66.73 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.684 -0.635 . . . . 0.0 110.742 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.61 22.54 4.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.357 -0.839 . . . . 0.0 110.35 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.06 54.85 10.27 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.435 ' CD2' HG21 ' A' ' 24' ' ' ILE . 4.8 mp -110.01 162.97 14.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.551 -0.97 . . . . 0.0 110.455 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.466 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -154.35 119.17 0.91 Allowed Glycine 0 N--CA 1.499 2.87 0 C-N-CA 120.031 -1.08 . . . . 0.0 111.721 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.447 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 31.39 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.465 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.0 m -66.1 -53.69 34.92 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.315 -0.866 . . . . 0.0 110.696 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -58.28 -32.78 68.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.587 -0.696 . . . . 0.0 110.169 -179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.496 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.2 OUTLIER -67.03 -36.73 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.892 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 179.038 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 t -59.81 -28.46 67.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.505 -0.747 . . . . 0.0 109.429 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.59 -51.84 60.67 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.6 m -75.12 -71.39 0.36 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.513 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -78.14 96.18 5.11 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 177.681 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -59.92 83.83 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -156.34 174.44 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.251 -0.905 . . . . 0.0 109.484 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.71 141.66 44.47 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.2 ppt_? -70.56 -38.76 74.18 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.076 -178.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 p -64.49 -40.78 96.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.995 -1.065 . . . . 0.0 108.814 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.2 m -64.17 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.88 -29.99 44.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.527 ' CD1' ' CD1' ' A' ' 39' ' ' ILE . 2.9 m-85 -72.12 -31.42 66.01 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.976 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -36.79 68.42 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.383 1.087 . . . . 0.0 108.206 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -68.6 -55.49 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.073 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.677 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 1.1 mt -54.65 -45.01 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 121.93 0.871 . . . . 0.0 109.478 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -60.56 -39.1 86.72 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -64.13 -28.9 70.09 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.274 -0.571 . . . . 0.0 109.626 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 t -69.96 -45.92 66.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.539 -0.725 . . . . 0.0 109.502 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.467 -179.963 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -79.43 85.77 5.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.59 -0.947 . . . . 0.0 109.424 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -102.81 40.54 1.36 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.541 -0.725 . . . . 0.0 109.534 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -96.75 40.83 1.12 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.565 -0.709 . . . . 0.0 109.346 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -87.75 -31.1 19.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.571 -0.706 . . . . 0.0 109.422 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.95 162.7 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.568 -0.707 . . . . 0.0 109.238 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -93.3 47.87 1.28 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.525 -0.734 . . . . 0.0 109.571 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 -87.11 -59.69 2.19 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.582 -0.699 . . . . 0.0 109.485 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -64.01 -24.56 67.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.611 -0.681 . . . . 0.0 109.92 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.95 -52.11 65.37 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.359 -0.838 . . . . 0.0 109.71 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.2 t -60.61 -34.83 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.6 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -61.2 -39.06 88.8 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.783 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -66.98 -26.31 66.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.419 -0.801 . . . . 0.0 109.981 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.447 ' HB3' ' CG2' ' A' ' 24' ' ' ILE . 3.2 mtm -67.4 -67.08 0.48 Allowed 'General case' 0 C--N 1.306 -1.288 0 O-C-N 121.345 -0.847 . . . . 0.0 111.146 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.586 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 90.0 m95 -66.23 -40.03 89.99 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.087 -1.008 . . . . 0.0 112.081 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.41 ' CG ' ' O ' ' A' ' 12' ' ' LEU . 14.8 mm100 -59.29 -20.83 57.58 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.662 -0.649 . . . . 0.0 110.815 -177.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -89.47 -27.33 20.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.324 -0.86 . . . . 0.0 109.75 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.72 68.84 0.55 Allowed Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.231 -1.548 . . . . 0.0 109.231 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.424 ' CD2' ' O ' ' A' ' 14' ' ' MET . 0.0 OUTLIER -120.9 162.61 19.55 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.626 -0.926 . . . . 0.0 109.995 -178.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.478 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -136.22 118.92 1.9 Allowed Glycine 0 N--CA 1.5 2.937 0 C-N-CA 120.264 -0.969 . . . . 0.0 111.586 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.452 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 31.22 -85.36 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 179.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 t -67.68 -53.11 30.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.3 -0.875 . . . . 0.0 110.55 -178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 19' ' ' LEU . 7.9 t60 -59.06 -26.49 64.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.595 -0.691 . . . . 0.0 110.551 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.492 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 0.2 OUTLIER -69.92 -36.44 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.889 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 179.402 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -64.41 -40.9 96.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.718 -0.614 . . . . 0.0 110.105 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -60.72 -34.4 74.35 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.475 -0.765 . . . . 0.0 109.926 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.4 m -71.25 -58.49 3.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.517 -0.739 . . . . 0.0 109.947 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 23.9 mmt -104.61 -140.83 0.36 Allowed 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -137.48 88.21 2.32 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.332 -1.48 . . . . 0.0 111.82 -178.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.1 pp -168.29 153.49 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 O-C-N 121.234 -0.916 . . . . 0.0 110.39 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.425 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -71.69 167.04 20.69 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -64.26 -41.47 96.94 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.236 -0.915 . . . . 0.0 111.529 -178.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.04 -30.22 58.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.163 -0.96 . . . . 0.0 108.953 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.3 m -63.93 -34.66 78.47 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.557 ' O ' HD11 ' A' ' 39' ' ' ILE . 2.5 t -63.58 -45.03 98.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.678 ' HA ' HD11 ' A' ' 39' ' ' ILE . 14.4 m-85 -62.94 -16.71 60.27 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 120.156 -0.618 . . . . 0.0 111.498 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.4 -39.1 85.56 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 175.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.3 t -71.49 -60.91 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.034 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.678 HD11 ' HA ' ' A' ' 36' ' ' TYR . 1.8 mp -55.67 -32.98 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 CA-C-O 121.758 0.79 . . . . 0.0 109.63 -176.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -65.54 -41.68 92.8 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.19 -34.08 76.86 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.714 -0.616 . . . . 0.0 109.476 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m 59.64 37.18 22.55 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.54 -0.725 . . . . 0.0 109.793 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.2 t30 . . . . . 0 N--CA 1.496 1.851 0 CA-C-O 117.997 -1.001 . . . . 0.0 109.711 179.988 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -65.23 157.55 28.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.575 -0.956 . . . . 0.0 109.41 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -102.21 88.91 3.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.626 -0.672 . . . . 0.0 109.566 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -65.18 -34.88 79.44 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.569 -0.707 . . . . 0.0 109.358 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -75.78 -169.68 1.13 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.626 -0.671 . . . . 0.0 109.326 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mm 61.24 105.8 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.484 -0.76 . . . . 0.0 109.551 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.41 -171.68 2.54 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.621 -0.674 . . . . 0.0 109.524 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 59.87 19.43 8.36 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.604 -0.685 . . . . 0.0 110.232 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.42 -33.93 73.71 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.284 -0.885 . . . . 0.0 109.674 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.11 72.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.558 -0.714 . . . . 0.0 109.773 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 10.6 t -76.94 -32.34 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.04 -22.74 67.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.469 -0.77 . . . . 0.0 109.427 179.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -83.5 -45.83 13.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.102 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.401 ' O ' ' CG2' ' A' ' 24' ' ' ILE . 24.0 ptp -71.03 -3.82 21.68 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.508 -0.745 . . . . 0.0 111.486 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.579 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 33.5 m95 -120.57 -42.46 2.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.463 -1.398 . . . . 0.0 111.22 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -78.7 0.67 25.75 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.382 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -103.77 22.71 13.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.097 -1.002 . . . . 0.0 110.041 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.59 63.55 2.32 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.465 ' CD1' ' CD2' ' A' ' 23' ' ' HIS . 0.8 OUTLIER -127.41 160.3 31.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.742 -0.858 . . . . 0.0 110.452 -178.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.426 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.5 125.23 1.41 Allowed Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.01 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.471 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 30.1 -84.41 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.1 t -63.92 -52.03 61.7 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.267 -0.896 . . . . 0.0 111.161 -177.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.465 ' CD2' ' CD1' ' A' ' 19' ' ' LEU . 7.3 t60 -61.49 -30.72 70.79 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.446 -0.783 . . . . 0.0 109.834 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.522 HD12 ' CH2' ' A' ' 15' ' ' TRP . 0.2 OUTLIER -77.26 -24.36 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.942 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.778 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.9 t -58.52 -48.32 81.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.966 -1.083 . . . . 0.0 110.319 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.412 ' NZ ' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -73.9 -36.72 64.78 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.531 -179.239 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.0 m -62.12 -69.56 0.24 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.35 -0.843 . . . . 0.0 109.759 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.418 ' CG ' ' O ' ' A' ' 24' ' ' ILE . 1.5 ptt? -80.07 -134.73 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -157.69 45.31 0.35 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.368 -1.458 . . . . 0.0 113.1 -178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 14.3 pt -154.25 166.6 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.958 178.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.21 162.48 2.64 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 110.404 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.459 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -72.55 -33.88 67.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.757 -0.589 . . . . 0.0 111.645 -178.825 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 12.3 p -74.78 -35.54 62.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.022 -1.048 . . . . 0.0 108.775 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 73.7 m -61.26 -33.22 73.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.42 HG22 ' HA ' ' A' ' 32' ' ' ARG . 0.5 OUTLIER -65.86 -40.89 88.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.605 ' HA ' HD11 ' A' ' 39' ' ' ILE . 12.3 m-85 -67.03 -13.77 62.24 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 119.421 -0.911 . . . . 0.0 110.981 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -69.05 -40.23 78.67 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.16 -1.792 . . . . 0.0 106.16 174.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.87 -56.06 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.282 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.605 HD11 ' HA ' ' A' ' 36' ' ' TYR . 4.2 mt -54.17 -34.12 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.407 -0.808 . . . . 0.0 109.316 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.33 -40.96 73.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -60.98 -30.29 70.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.703 -0.623 . . . . 0.0 109.795 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t 62.18 -86.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.93 -0.482 . . . . 0.0 109.827 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.496 1.831 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.773 -179.938 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -69.21 103.79 2.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.575 -0.956 . . . . 0.0 109.488 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.96 113.92 4.77 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.672 -0.643 . . . . 0.0 109.479 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -57.17 10.39 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.553 -0.717 . . . . 0.0 109.471 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 158.68 24.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.605 -0.685 . . . . 0.0 109.407 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.4 pp -141.99 125.45 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.606 -0.684 . . . . 0.0 109.457 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -110.73 168.81 9.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.561 -0.712 . . . . 0.0 109.504 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.9 ptt180 41.48 49.29 3.53 Favored 'General case' 0 N--CA 1.507 2.394 0 CA-C-O 121.229 0.537 . . . . 0.0 111.772 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.69 -28.67 61.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.336 -0.852 . . . . 0.0 109.564 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.06 -54.84 5.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.546 -0.721 . . . . 0.0 110.029 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.0 t -58.78 -40.19 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 109.176 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.5 tt -59.2 -39.07 81.48 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -57.44 -33.85 68.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.446 -0.784 . . . . 0.0 109.079 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.466 ' HG3' ' CB ' ' A' ' 28' ' ' MET . 16.3 mmt -62.59 -45.92 90.65 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.827 -0.546 . . . . 0.0 109.655 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.632 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 32.8 m95 -79.54 -0.27 32.73 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.171 -0.955 . . . . 0.0 111.079 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -100.33 -21.5 15.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.962 -1.086 . . . . 0.0 111.321 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -95.62 10.61 36.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.133 -0.98 . . . . 0.0 111.362 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.24 65.58 1.52 Allowed Glycine 0 N--CA 1.496 2.642 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.49 ' HB3' ' CG1' ' A' ' 24' ' ' ILE . 7.4 mp -124.18 -172.59 2.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.668 -0.901 . . . . 0.0 109.309 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -164.62 120.87 0.97 Allowed Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.002 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 17.38 -72.45 0.0 OUTLIER 'General case' 0 N--CA 1.522 3.163 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 20' ' ' GLY . 41.6 m -50.61 -59.98 3.5 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.118 -0.989 . . . . 0.0 110.361 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.44 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 5.9 t60 -65.65 -38.42 89.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.392 -0.818 . . . . 0.0 109.341 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.506 HD12 ' CD2' ' A' ' 15' ' ' TRP . 38.6 mt -72.96 -7.23 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.609 -0.682 . . . . 0.0 110.36 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.417 ' CB ' ' HA ' ' A' ' 30' ' ' ILE . 1.0 OUTLIER -87.21 -68.62 0.74 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.545 -0.722 . . . . 0.0 110.054 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -26.17 41.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.623 -0.673 . . . . 0.0 110.685 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.8 t -85.67 -36.57 20.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.495 -0.753 . . . . 0.0 109.942 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.466 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -141.17 112.89 7.66 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -178.549 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.411 ' O ' ' CG2' ' A' ' 35' ' ' VAL . 4.3 t-20 40.35 90.08 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.707 -0.621 . . . . 0.0 111.862 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.431 HD11 HG22 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -58.02 -162.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.679 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.452 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . 63.38 105.47 0.03 OUTLIER 'General case' 0 C--O 1.193 -1.876 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -57.62 -52.83 63.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.686 -0.634 . . . . 0.0 111.66 -176.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -57.78 -40.98 81.11 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.112 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -67.57 -31.75 72.03 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.952 0.882 . . . . 0.0 108.938 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.452 ' CG2' ' O ' ' A' ' 31' ' ' ALA . 89.1 t -66.69 -31.19 52.4 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.462 ' CE1' HD11 ' A' ' 39' ' ' ILE . 16.2 m-85 -76.25 -23.02 54.46 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.368 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -37.85 84.12 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.3 t -67.94 -52.72 36.35 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.344 179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.632 ' CD1' ' CZ2' ' A' ' 15' ' ' TRP . 4.5 mt -58.43 -36.65 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-O 121.819 0.819 . . . . 0.0 110.052 -176.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -66.05 -36.98 84.71 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -57.15 -21.31 31.8 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.723 -0.611 . . . . 0.0 110.117 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.4 t -57.05 -53.28 59.85 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.349 -0.845 . . . . 0.0 109.949 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.8 p30 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.488 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -95.78 108.03 20.32 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.618 -0.931 . . . . 0.0 109.517 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -71.35 162.36 29.56 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.607 -0.683 . . . . 0.0 109.454 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -90.54 -172.28 3.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.581 -0.7 . . . . 0.0 109.525 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -101.88 169.84 8.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.557 -0.714 . . . . 0.0 109.544 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.6 pp -143.14 133.78 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.581 -0.7 . . . . 0.0 109.496 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -103.81 103.12 12.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.609 -0.682 . . . . 0.0 109.512 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -62.13 -37.28 84.55 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.602 -0.686 . . . . 0.0 109.85 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.06 -26.3 66.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.519 -0.738 . . . . 0.0 110.163 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -53.07 59.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.467 -0.771 . . . . 0.0 109.915 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.419 ' HA ' ' CE ' ' A' ' 14' ' ' MET . 45.4 t -59.43 -34.6 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.287 -0.883 . . . . 0.0 109.387 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 16.1 mt -65.27 -33.48 76.07 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -66.56 -31.02 71.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.164 -0.96 . . . . 0.0 110.562 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.42 ' HB3' HG21 ' A' ' 24' ' ' ILE . 16.4 mtm -70.51 -61.04 1.92 Allowed 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.278 -0.889 . . . . 0.0 111.372 -178.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 97.7 m95 -76.33 -42.01 46.49 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.295 -0.878 . . . . 0.0 112.963 -176.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 7.9 mm100 -63.25 -26.42 68.77 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.599 -0.688 . . . . 0.0 110.489 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -78.38 -24.41 46.37 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.311 -0.868 . . . . 0.0 109.807 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.12 63.13 0.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.492 ' CD2' ' CD2' ' A' ' 23' ' ' HIS . 8.4 mt -119.51 -173.63 2.56 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.932 . . . . 0.0 110.831 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -145.45 116.51 0.91 Allowed Glycine 0 N--CA 1.498 2.832 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.469 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 10.1 -65.35 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.3 1.592 . . . . 0.0 115.3 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.5 m -45.61 -57.44 4.18 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.07 -1.019 . . . . 0.0 110.826 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.492 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 10.2 t60 -81.52 -31.0 33.0 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.392 -0.818 . . . . 0.0 109.365 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.496 HD11 ' CH2' ' A' ' 15' ' ' TRP . 67.8 mt -61.82 -21.99 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.298 -0.876 . . . . 0.0 110.613 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 p -109.05 -54.45 2.53 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.307 -0.871 . . . . 0.0 110.596 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -24.86 65.1 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.434 -0.791 . . . . 0.0 110.235 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.409 ' OG1' ' CD2' ' A' ' 23' ' ' HIS . 18.4 m -86.4 -57.01 3.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.453 -0.779 . . . . 0.0 109.828 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -101.97 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.402 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 25.7 t-20 -163.58 64.66 0.17 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.551 -1.343 . . . . 0.0 111.039 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.402 ' CG2' ' O ' ' A' ' 29' ' ' ASN . 0.7 OUTLIER -176.43 -175.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 O-C-N 121.084 -1.01 . . . . 0.0 110.075 179.471 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.42 ' O ' ' CG2' ' A' ' 35' ' ' VAL . . . -97.83 170.64 8.83 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.415 ' CD ' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -64.4 -46.67 82.26 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 0.0 111.703 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 1.0 OUTLIER -67.88 -36.25 79.92 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.206 -0.934 . . . . 0.0 108.753 -179.605 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.6 m -61.06 -35.23 76.39 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.533 ' CG1' HD13 ' A' ' 39' ' ' ILE . 12.2 t -64.17 -34.22 67.46 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.309 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.61 ' HA ' HD11 ' A' ' 39' ' ' ILE . 13.4 m-85 -75.28 -15.36 60.52 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.397 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.28 -39.42 86.01 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.408 ' CG1' ' CG1' ' A' ' 11' ' ' VAL . 2.1 t -74.47 -55.01 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.237 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.61 HD11 ' HA ' ' A' ' 36' ' ' TYR . 6.3 mt -56.03 -33.28 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.407 -0.808 . . . . 0.0 109.631 -177.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.17 -40.6 82.27 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -63.48 -28.1 69.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.79 -0.569 . . . . 0.0 109.586 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t 61.05 32.62 19.79 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.441 -0.787 . . . . 0.0 109.584 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.454 -179.992 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -102.53 139.03 38.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.612 -0.934 . . . . 0.0 109.512 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.71 30.68 3.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.638 -0.664 . . . . 0.0 109.474 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -88.63 82.08 6.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.552 -0.718 . . . . 0.0 109.453 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -102.68 71.28 1.17 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.585 -0.697 . . . . 0.0 109.381 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 46.0 mm -132.39 65.63 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.507 -0.746 . . . . 0.0 109.517 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.24 44.92 0.99 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.446 -0.784 . . . . 0.0 109.28 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 173.62 75.64 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.83 -29.14 60.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.515 -0.74 . . . . 0.0 109.703 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.15 -59.05 3.52 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.579 -0.701 . . . . 0.0 109.678 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 46.0 t -60.87 -38.4 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.564 -0.71 . . . . 0.0 109.626 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 31.9 mt -70.98 -21.72 62.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 110.359 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -71.74 -47.4 54.03 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.999 -1.063 . . . . 0.0 110.709 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.405 ' HB2' HG21 ' A' ' 24' ' ' ILE . 12.7 ptp -73.32 -48.21 36.26 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.295 -0.878 . . . . 0.0 112.339 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.508 ' NE1' ' CD1' ' A' ' 39' ' ' ILE . 75.3 m95 -65.57 -49.83 67.36 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.653 -1.279 . . . . 0.0 111.686 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 mm-40 -62.81 -25.8 68.43 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.901 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -71.33 -29.57 65.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.315 -0.866 . . . . 0.0 109.114 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.26 50.84 0.21 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.431 ' CD2' HG21 ' A' ' 24' ' ' ILE . 1.7 mp -112.07 168.96 9.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.589 -0.948 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.457 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -153.67 117.76 0.82 Allowed Glycine 0 N--CA 1.498 2.805 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.851 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.463 ' N ' ' CG1' ' A' ' 24' ' ' ILE . . . 34.94 -86.6 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -70.96 -51.65 24.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.174 -0.954 . . . . 0.0 110.236 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -57.39 -30.49 64.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.607 -0.683 . . . . 0.0 110.142 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.505 HD12 ' CZ2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -65.43 -39.7 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.752 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.53 -32.42 68.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.703 -0.623 . . . . 0.0 109.84 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -43.78 98.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.573 -0.704 . . . . 0.0 109.162 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.4 m -74.1 -66.58 0.7 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.547 -0.72 . . . . 0.0 109.414 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 3.4 mtm -117.14 109.97 17.59 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -45.35 102.53 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.706 -0.621 . . . . 0.0 112.063 -178.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.7 pt -143.79 159.4 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.64 -0.663 . . . . 0.0 109.9 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.51 150.75 24.46 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 33' ' ' SER . 33.5 ptt180 -77.57 -46.48 22.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.914 -1.116 . . . . 0.0 111.893 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.436 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 47.2 p -71.49 -39.1 71.06 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.18 -0.95 . . . . 0.0 108.577 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.9 m -59.78 -46.84 87.95 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.465 1.126 . . . . 0.0 108.804 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 39' ' ' ILE . 27.3 t -60.08 -38.68 77.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.454 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.8 m-85 -69.01 -18.94 64.11 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.24 -178.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -61.28 -37.58 83.7 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 174.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -49.13 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.818 179.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.508 ' CD1' ' NE1' ' A' ' 15' ' ' TRP . 7.6 mm -57.37 -37.61 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.884 -1.135 . . . . 0.0 110.086 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -68.82 -40.25 79.59 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.18 -14.41 62.26 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.838 -0.539 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 61.15 30.37 19.32 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.144 -0.973 . . . . 0.0 109.568 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.003 -0.998 . . . . 0.0 109.32 179.888 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.7 ptt180 -59.08 -27.32 65.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.452 -1.028 . . . . 0.0 110.077 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 116.25 3.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.526 -0.734 . . . . 0.0 110.008 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.12 -59.77 1.55 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.595 -0.691 . . . . 0.0 109.405 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -87.97 -172.03 3.66 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.595 -0.69 . . . . 0.0 109.464 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.439 HG21 HD11 ' A' ' 6' ' ' ILE . 46.3 mm -66.92 121.36 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.567 -0.708 . . . . 0.0 109.392 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -64.62 -170.34 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.698 . . . . 0.0 109.125 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -96.37 27.45 3.76 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.484 -0.76 . . . . 0.0 109.99 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.33 -23.95 62.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.413 -0.804 . . . . 0.0 109.88 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.75 -54.31 37.33 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 109.768 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 56.7 t -58.07 -39.91 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.471 -0.768 . . . . 0.0 109.614 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 95.6 mt -59.7 -37.75 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.68 -0.637 . . . . 0.0 109.777 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -65.87 -28.13 68.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.59 -0.693 . . . . 0.0 109.968 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.561 ' HG3' ' HB2' ' A' ' 28' ' ' MET . 25.4 mmt -63.97 -52.86 57.69 Favored 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.388 -0.82 . . . . 0.0 109.766 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 86.5 m95 -63.93 -31.81 73.12 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.257 -0.902 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -67.58 -18.87 65.15 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.804 -0.56 . . . . 0.0 110.713 -178.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -95.91 14.12 24.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.263 -0.898 . . . . 0.0 110.663 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.28 63.06 2.45 Favored Glycine 0 N--CA 1.495 2.611 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.43 HD13 ' CD2' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -118.43 153.98 33.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.697 -0.884 . . . . 0.0 110.293 -179.224 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.429 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -141.32 121.8 1.95 Allowed Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.349 -0.929 . . . . 0.0 110.961 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.427 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 29.18 -84.78 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.3 m -64.12 -54.14 38.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.334 -0.854 . . . . 0.0 111.097 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.43 ' CD2' HD13 ' A' ' 19' ' ' LEU . 6.6 t60 -60.15 -32.79 71.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 -178.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.495 ' CD1' ' CH2' ' A' ' 15' ' ' TRP . 0.3 OUTLIER -64.36 -32.68 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.076 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -69.93 -27.71 64.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.661 -0.65 . . . . 0.0 109.496 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -47.61 83.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.283 -0.886 . . . . 0.0 109.031 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -74.16 -64.1 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.561 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -98.98 98.06 9.15 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.017 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -52.15 89.26 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.664 -0.647 . . . . 0.0 112.334 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -151.39 161.99 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.172 -0.955 . . . . 0.0 109.111 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.41 158.83 35.02 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.341 -0.849 . . . . 0.0 109.429 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -42.33 81.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.55 -0.719 . . . . 0.0 111.213 -179.06 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 p -72.46 -32.84 66.58 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.064 -1.022 . . . . 0.0 108.37 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.6 m -62.23 -30.28 70.98 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.429 ' CG1' HD13 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -68.23 -40.54 82.88 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.664 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.746 ' HA ' HD11 ' A' ' 39' ' ' ILE . 20.3 m-85 -67.1 -11.98 58.7 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.762 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -74.58 -39.06 62.48 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.7 -54.38 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.147 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.746 HD11 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mt -55.69 -38.13 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.906 -177.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -66.04 -40.84 91.33 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -61.76 -28.89 69.77 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.708 -0.62 . . . . 0.0 109.754 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -96.86 85.94 3.91 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.5 -0.75 . . . . 0.0 109.528 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 118.028 -0.986 . . . . 0.0 109.728 179.993 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -70.38 -24.6 62.98 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.948 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -67.19 0.42 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.426 -0.796 . . . . 0.0 109.997 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.633 HG21 HG11 ' A' ' 38' ' ' VAL . 20.7 t -65.45 -32.39 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.5 -0.75 . . . . 0.0 109.643 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.488 HD23 ' O ' ' A' ' 12' ' ' LEU . 8.7 tt -61.03 -22.49 64.61 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.588 -0.695 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -92.86 -44.05 8.68 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.825 ' O ' HD13 ' A' ' 19' ' ' LEU . 1.7 mpp? -61.69 -14.1 28.61 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.462 -0.774 . . . . 0.0 111.615 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.864 ' NE1' HD11 ' A' ' 39' ' ' ILE . 69.0 m95 -113.0 -42.72 3.51 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.725 -1.235 . . . . 0.0 110.869 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -75.64 -3.96 37.48 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.527 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -95.36 -29.3 14.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.089 -1.007 . . . . 0.0 109.519 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.94 75.94 0.42 Allowed Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.825 HD13 ' O ' ' A' ' 14' ' ' MET . 4.9 mp -133.25 -173.43 3.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.483 -1.01 . . . . 0.0 110.031 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.61 116.97 0.74 Allowed Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.03 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.651 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.01 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 22.0 t -61.76 -56.4 19.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 110.667 -178.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -57.92 -27.6 63.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.482 -0.761 . . . . 0.0 110.533 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.706 HG22 ' HE2' ' A' ' 28' ' ' MET . 0.3 OUTLIER -72.45 -39.01 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.806 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.65 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 99.1 p -65.2 -46.32 81.22 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.695 -0.628 . . . . 0.0 110.052 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -28.14 67.21 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.743 . . . . 0.0 109.829 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 m -79.32 -38.46 35.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.528 -0.732 . . . . 0.0 110.361 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.706 ' HE2' HG22 ' A' ' 24' ' ' ILE . 2.6 ptt? -110.27 -153.22 0.51 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.441 ' O ' HG23 ' A' ' 30' ' ' ILE . 8.4 p-10 -120.4 46.75 1.91 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.263 -0.898 . . . . 0.0 112.315 -177.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.684 ' CD1' HG22 ' A' ' 35' ' ' VAL . 15.4 pt -153.91 148.58 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 120.801 -1.187 . . . . 0.0 110.636 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.695 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -62.73 174.28 1.08 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.653 -0.654 . . . . 0.0 109.836 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.594 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -75.61 -41.48 54.33 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 111.662 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.411 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 4.9 t -68.93 -37.42 78.89 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.4 m -64.06 -37.3 86.93 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 31' ' ' ALA . 14.4 t -60.37 -41.2 86.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.7 m-85 -70.25 -18.42 63.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.973 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -59.98 -36.63 77.55 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 174.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 HG21 ' A' ' 11' ' ' VAL . 17.4 t -72.82 -57.44 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.449 178.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.864 HD11 ' NE1' ' A' ' 15' ' ' TRP . 6.0 mm -52.98 -31.35 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.837 0.827 . . . . 0.0 110.61 -176.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -74.34 -41.0 61.79 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -60.65 -33.31 72.63 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.709 -0.619 . . . . 0.0 109.796 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.497 1.884 0 O-C-N 121.49 -0.756 . . . . 0.0 109.725 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? . . . . . 0 N--CA 1.483 1.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -22.67 65.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.559 -0.713 . . . . 0.0 109.976 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.94 -50.86 30.03 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.408 -0.807 . . . . 0.0 109.769 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.554 ' CG1' HG13 ' A' ' 35' ' ' VAL . 46.8 t -60.65 -44.65 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.504 -0.747 . . . . 0.0 109.429 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.555 HD13 ' OG ' ' A' ' 42' ' ' SER . 6.8 tp -63.55 -30.97 72.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.779 -0.576 . . . . 0.0 109.786 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -66.26 -30.71 71.2 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.377 -0.827 . . . . 0.0 110.142 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.511 ' O ' HD22 ' A' ' 19' ' ' LEU . 6.6 mmt -70.89 -56.48 6.18 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 121.429 -0.794 . . . . 0.0 110.285 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CE2' HG21 ' A' ' 24' ' ' ILE . 98.3 m95 -58.86 -40.03 83.12 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.318 -0.864 . . . . 0.0 111.494 -178.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -67.95 -16.31 64.0 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.823 -0.548 . . . . 0.0 111.891 -176.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.424 ' HB2' HD13 ' A' ' 19' ' ' LEU . 72.0 mt-30 -94.82 22.04 6.86 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.161 -0.962 . . . . 0.0 110.773 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.728 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 72.95 54.08 7.42 Favored Glycine 0 N--CA 1.5 2.939 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.728 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.5 mp -122.91 -170.8 2.17 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.924 . . . . 0.0 108.938 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.548 ' N ' HG12 ' A' ' 24' ' ' ILE . . . 178.39 116.13 0.48 Allowed Glycine 0 N--CA 1.499 2.864 0 C-N-CA 119.376 -1.392 . . . . 0.0 112.899 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.458 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 32.55 -78.98 0.0 OUTLIER 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 20' ' ' GLY . 29.6 t -44.16 -42.51 6.45 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.419 ' ND1' HD23 ' A' ' 19' ' ' LEU . 20.6 t-80 -94.57 -29.47 14.87 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 177.006 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.743 HG21 ' CE2' ' A' ' 15' ' ' TRP . 16.6 mm -76.19 8.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 121.217 -0.927 . . . . 0.0 110.762 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.7 m -137.4 -35.13 0.68 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.052 -1.03 . . . . 0.0 111.05 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.36 -36.22 16.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.833 -1.167 . . . . 0.0 110.305 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 32.2 m -91.39 -28.84 17.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.42 -0.8 . . . . 0.0 111.301 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.459 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -101.01 34.18 2.59 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.232 -0.917 . . . . 0.0 109.402 -178.657 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.518 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.9 p-10 33.95 58.64 0.59 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 177.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.799 HD12 ' CG2' ' A' ' 35' ' ' VAL . 6.0 pt -157.79 172.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.524 -0.735 . . . . 0.0 109.054 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -96.69 156.4 16.36 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.41 ' HG3' ' N ' ' A' ' 33' ' ' SER . 8.2 ptp180 -78.0 -45.93 22.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.848 -1.158 . . . . 0.0 111.53 -178.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -63.99 -42.25 97.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.11 -0.994 . . . . 0.0 108.943 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.2 m -63.68 -44.84 92.55 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 122.574 1.178 . . . . 0.0 108.236 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.926 HG12 HD11 ' A' ' 39' ' ' ILE . 12.0 t -63.4 -21.5 28.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' ILE . 2.1 m-85 -79.08 -24.54 43.43 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.21 -0.931 . . . . 0.0 110.137 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 mtpt -61.96 -37.45 84.8 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.86 -54.28 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.997 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.926 HD11 HG12 ' A' ' 35' ' ' VAL . 12.2 mt -53.99 -30.74 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 O-C-N 121.449 -0.782 . . . . 0.0 110.077 -178.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -72.69 -41.19 65.56 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.97 22.58 7.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.773 -0.579 . . . . 0.0 109.863 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.555 ' OG ' HD13 ' A' ' 12' ' ' LEU . 25.6 t . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 109.423 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.13 -23.33 62.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.626 -0.671 . . . . 0.0 109.972 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.798 ' HB1' ' HE1' ' A' ' 28' ' ' MET . . . -62.34 -55.74 25.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.388 -0.82 . . . . 0.0 109.731 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.607 HG22 ' SD ' ' A' ' 28' ' ' MET . 40.8 t -66.89 -42.1 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.493 -0.755 . . . . 0.0 109.285 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -26.45 61.85 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.567 -0.708 . . . . 0.0 109.946 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.8 -32.64 20.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.367 -0.833 . . . . 0.0 109.357 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.646 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -82.64 5.11 22.19 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.623 -0.673 . . . . 0.0 111.141 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.595 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 10.1 m95 -128.24 -49.47 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.386 1.089 . . . . 0.0 109.691 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.06 -15.25 61.51 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.008 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -80.16 -27.68 38.94 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.191 -0.943 . . . . 0.0 109.48 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.77 65.85 0.26 Allowed Glycine 0 N--CA 1.496 2.64 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.648 HD23 ' ND1' ' A' ' 23' ' ' HIS . 4.9 mp -127.98 -171.74 2.52 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.497 -1.002 . . . . 0.0 110.158 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.439 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -154.55 112.21 0.52 Allowed Glycine 0 N--CA 1.496 2.677 0 C-N-CA 119.647 -1.263 . . . . 0.0 111.777 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 16.25 -74.31 0.0 OUTLIER 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.4 p -48.65 -59.35 3.59 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.179 -0.951 . . . . 0.0 110.776 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.648 ' ND1' HD23 ' A' ' 19' ' ' LEU . 13.3 t-80 -64.93 -37.51 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.775 HD12 ' N ' ' A' ' 21' ' ' ALA . 78.8 mt -66.73 -14.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.813 -0.554 . . . . 0.0 110.283 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 p -81.18 -40.79 23.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 108.789 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' N ' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -66.18 -55.33 16.84 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.745 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.453 HG23 ' N ' ' A' ' 28' ' ' MET . 4.1 t -62.64 -48.24 80.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.638 -0.664 . . . . 0.0 109.461 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.798 ' HE1' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -107.44 93.57 4.62 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 178.506 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.735 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.0 t-20 -47.94 96.36 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.06 HD12 HG22 ' A' ' 35' ' ' VAL . 1.2 pt -172.01 147.95 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.955 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -61.27 155.92 19.92 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.808 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -64.31 -35.2 80.08 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.185 -0.947 . . . . 0.0 111.244 -178.361 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 86.9 p -75.42 -36.73 60.73 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.144 -0.973 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.7 m -61.8 -34.96 76.85 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 1.06 HG22 HD12 ' A' ' 30' ' ' ILE . 8.9 t -66.08 -34.79 72.61 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.39 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 39' ' ' ILE . 16.1 m-85 -75.25 -13.3 60.43 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.85 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -68.98 -38.4 79.3 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 174.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.4 HG11 HG11 ' A' ' 11' ' ' VAL . 2.1 t -76.7 -54.38 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.094 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.908 HD11 HG12 ' A' ' 35' ' ' VAL . 5.6 mt -56.07 -34.26 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.414 -0.804 . . . . 0.0 109.563 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 36' ' ' TYR . 39.4 m-20 -69.79 -40.71 75.85 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -59.94 -28.75 67.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.923 -0.485 . . . . 0.0 109.773 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.53 -0.731 . . . . 0.0 109.346 179.909 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 121.034 0.445 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -62.27 -31.05 71.57 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.521 -0.737 . . . . 0.0 109.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.53 -42.04 98.45 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.585 -0.697 . . . . 0.0 109.881 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 38' ' ' VAL . 45.8 t -62.6 -49.28 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.529 -0.732 . . . . 0.0 109.076 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.65 -8.71 57.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.733 -0.604 . . . . 0.0 110.486 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -77.65 -38.03 48.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.866 -1.147 . . . . 0.0 109.748 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.542 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.9 mmt -83.66 -45.26 13.64 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.495 -0.753 . . . . 0.0 110.45 -179.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CH2' HD11 ' A' ' 24' ' ' ILE . 35.0 m95 -55.14 -51.24 67.08 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.924 -1.11 . . . . 0.0 110.14 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -63.68 -28.27 69.79 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.472 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -73.89 -29.31 62.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.281 -0.887 . . . . 0.0 109.318 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.94 65.32 0.23 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.803 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -133.47 160.56 37.05 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.446 -1.032 . . . . 0.0 109.963 -179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.48 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -138.59 121.91 2.26 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.484 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 28.45 -83.4 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.5 t -64.43 -56.35 14.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.411 -0.806 . . . . 0.0 111.235 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.475 ' ND1' HD23 ' A' ' 19' ' ' LEU . 35.9 t-80 -57.04 -30.03 63.9 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.369 -0.832 . . . . 0.0 110.21 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.803 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.49 -34.61 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.7 p -62.78 -34.58 77.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.634 -0.666 . . . . 0.0 109.331 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -34.83 78.8 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.41 ' O ' ' HE3' ' A' ' 28' ' ' MET . 2.2 m -88.89 -76.42 0.4 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.823 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.436 ' HE2' ' HA ' ' A' ' 28' ' ' MET . 19.1 mmt -155.79 82.78 1.02 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.282 -0.886 . . . . 0.0 110.032 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.85 ' OD1' HG11 ' A' ' 35' ' ' VAL . 1.6 t-20 -152.74 -41.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.726 -1.234 . . . . 0.0 112.756 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER 50.75 145.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.915 0 CA-C-O 121.834 0.826 . . . . 0.0 112.359 -177.86 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.715 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 40.03 97.27 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.684 -0.635 . . . . 0.0 111.248 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.653 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -68.61 -42.53 77.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.969 -1.082 . . . . 0.0 112.535 -177.849 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 70.8 m -63.72 -43.9 95.18 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.045 -1.035 . . . . 0.0 108.845 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -63.1 -36.22 82.86 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.176 0.988 . . . . 0.0 108.617 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.895 HG12 HD11 ' A' ' 39' ' ' ILE . 38.0 t -65.2 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.736 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.6 m-85 -75.48 -21.0 58.43 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -64.18 -36.23 83.39 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 175.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 11' ' ' VAL . 3.2 t -74.41 -56.12 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.162 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.895 HD11 HG12 ' A' ' 35' ' ' VAL . 5.7 mt -55.53 -32.49 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.356 -0.84 . . . . 0.0 109.828 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -69.75 -40.4 76.15 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -62.73 -30.26 71.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.769 -0.582 . . . . 0.0 109.569 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.626 -0.671 . . . . 0.0 109.437 179.994 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.041 0.448 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.17 -33.96 75.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.586 -0.696 . . . . 0.0 109.424 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.86 70.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.595 -0.69 . . . . 0.0 109.425 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 38' ' ' VAL . 47.0 t -65.35 -50.69 71.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.01 -23.81 67.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.669 -0.644 . . . . 0.0 109.718 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -63.28 -45.32 91.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.169 -0.957 . . . . 0.0 109.698 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 9.6 mmt -64.27 -43.11 95.84 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.463 -0.773 . . . . 0.0 110.025 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.651 ' CE2' HG21 ' A' ' 24' ' ' ILE . 80.0 m95 -67.78 -25.02 65.4 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.003 -1.061 . . . . 0.0 112.184 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -97.1 13.12 30.27 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.535 -0.728 . . . . 0.0 112.476 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.488 ' HB2' HD21 ' A' ' 19' ' ' LEU . 20.6 mm-40 -105.85 -22.25 12.97 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.073 -1.017 . . . . 0.0 110.562 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.44 -49.68 0.81 Allowed Glycine 0 N--CA 1.498 2.785 0 N-CA-C 108.42 -1.872 . . . . 0.0 108.42 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 1.124 HD12 HD13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -48.47 173.78 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 122.015 -0.697 . . . . 0.0 110.979 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.511 ' HA2' HG13 ' A' ' 24' ' ' ILE . . . -167.45 135.64 3.75 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.954 -1.117 . . . . 0.0 111.503 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.584 ' HB1' ' CB ' ' A' ' 32' ' ' ARG . . . 36.68 -83.41 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.442 ' N ' ' O ' ' A' ' 20' ' ' GLY . 2.9 m -47.99 -52.26 20.51 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.383 -0.823 . . . . 0.0 109.468 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.802 ' CE1' HG21 ' A' ' 27' ' ' THR . 9.4 t-80 -78.77 -31.65 46.22 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 177.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 1.124 HD13 HD12 ' A' ' 19' ' ' LEU . 19.1 mm -71.7 1.73 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.284 -0.885 . . . . 0.0 110.525 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 t -110.64 -67.02 1.02 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.835 -1.165 . . . . 0.0 110.031 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -26.43 68.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.614 -0.679 . . . . 0.0 110.555 -178.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.802 HG21 ' CE1' ' A' ' 23' ' ' HIS . 7.5 m -90.89 -37.33 13.63 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.35 -0.844 . . . . 0.0 111.424 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.753 ' HE1' HG22 ' A' ' 24' ' ' ILE . 48.9 ttp -91.5 -80.12 0.36 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.138 -0.976 . . . . 0.0 109.972 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.472 ' O ' HG23 ' A' ' 30' ' ' ILE . 57.7 t30 -137.25 -61.35 0.65 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.017 -1.052 . . . . 0.0 113.079 -177.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.668 HD13 ' HB ' ' A' ' 34' ' ' THR . 1.4 pp -155.0 -177.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.987 -1.07 . . . . 0.0 112.279 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -34.92 142.14 0.05 Allowed 'General case' 0 N--CA 1.505 2.295 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.34 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.584 ' CB ' ' HB1' ' A' ' 21' ' ' ALA . 1.6 ptt180 -65.76 -22.2 66.57 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.92 -0.487 . . . . 0.0 111.895 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.1 t -64.22 -50.63 67.26 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.668 ' HB ' HD13 ' A' ' 30' ' ' ILE . 81.9 m -63.92 -38.93 92.9 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.487 1.137 . . . . 0.0 107.975 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.934 HG12 HD11 ' A' ' 39' ' ' ILE . 39.7 t -61.69 -26.35 39.47 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.446 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 39' ' ' ILE . 6.5 m-85 -78.59 -23.99 45.68 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.569 -0.707 . . . . 0.0 110.395 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -38.27 83.54 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 11' ' ' VAL . 2.2 t -76.5 -53.61 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.421 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.934 HD11 HG12 ' A' ' 35' ' ' VAL . 14.8 mt -53.35 -30.76 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.425 -0.797 . . . . 0.0 110.183 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -75.5 -42.49 52.71 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -61.49 -23.28 65.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.846 -0.534 . . . . 0.0 110.009 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.072 0 O-C-N 121.572 -0.705 . . . . 0.0 109.692 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -82.06 -20.13 38.88 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.583 -0.698 . . . . 0.0 110.226 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.41 67.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.0 109.805 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.48 -53.35 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.538 -0.726 . . . . 0.0 109.611 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD13 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -55.23 -40.33 70.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.603 -0.686 . . . . 0.0 110.742 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -76.86 -40.87 46.15 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.663 -0.648 . . . . 0.0 111.991 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.743 ' C ' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -85.1 10.11 13.0 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.071 -1.018 . . . . 0.0 111.632 -178.177 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.868 ' NE1' HD11 ' A' ' 39' ' ' ILE . 6.4 m95 -121.52 -53.1 2.01 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.842 -1.161 . . . . 0.0 109.9 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.576 ' HG3' HD13 ' A' ' 12' ' ' LEU . 11.5 mm100 -76.79 -16.84 59.34 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.157 -175.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -74.21 -27.22 60.69 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.205 -0.934 . . . . 0.0 109.104 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.583 ' O ' HD13 ' A' ' 19' ' ' LEU . . . 128.49 66.93 0.12 Allowed Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.743 HD23 ' C ' ' A' ' 14' ' ' MET . 2.6 mm? -126.02 -173.43 2.85 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.46 -1.023 . . . . 0.0 110.645 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -170.24 112.79 0.48 Allowed Glycine 0 N--CA 1.49 2.26 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.611 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 27.32 -83.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.8 m -60.61 -56.57 19.78 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.3 -0.875 . . . . 0.0 110.791 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' HD12 ' A' ' 19' ' ' LEU . 43.9 t-80 -58.02 -30.51 66.17 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.655 HG23 ' O ' ' A' ' 14' ' ' MET . 0.3 OUTLIER -67.97 -36.36 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.772 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.8 t -59.66 -29.94 68.41 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.475 -0.765 . . . . 0.0 109.285 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.36 -52.07 50.7 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.595 -0.691 . . . . 0.0 109.142 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.417 HG21 ' HG3' ' A' ' 14' ' ' MET . 54.6 m -74.23 -72.3 0.29 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.504 ' HE2' ' HB2' ' A' ' 14' ' ' MET . 1.9 ttm -80.93 99.01 8.15 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.7 t30 -57.57 88.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.958 -0.464 . . . . 0.0 111.076 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.708 HD13 HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -160.51 160.97 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 O-C-N 121.463 -0.773 . . . . 0.0 110.04 178.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.59 151.53 47.16 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.574 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 5.1 ptt-85 -75.44 -43.36 50.11 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.358 -0.839 . . . . 0.0 111.459 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -63.82 -43.17 97.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 109.183 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.3 m -57.73 -43.37 85.26 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.711 1.243 . . . . 0.0 108.323 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.708 HG21 HD13 ' A' ' 30' ' ' ILE . 3.2 t -58.93 -37.43 67.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.481 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 4.1 m-85 -71.02 -22.33 62.16 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.478 -0.889 . . . . 0.0 111.43 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mppp? -59.12 -36.36 75.05 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 175.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -71.74 -55.52 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.419 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.868 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.4 mm -53.36 -31.84 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.255 0 CA-C-O 121.842 0.83 . . . . 0.0 110.622 -176.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -71.83 -41.93 67.59 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -91.38 16.67 9.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.709 -0.619 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 109.427 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.614 ' O ' HD13 ' A' ' 12' ' ' LEU . 9.8 mmt180 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 121.384 0.611 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -69.23 -23.22 63.85 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.524 -0.735 . . . . 0.0 109.828 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.44 -61.7 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.461 -0.775 . . . . 0.0 109.695 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 38' ' ' VAL . 26.5 t -57.99 -34.17 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.468 -0.77 . . . . 0.0 109.762 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 8' ' ' ARG . 5.7 mp -67.03 -35.52 80.06 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -65.09 -27.82 69.03 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.601 ' HB3' HG23 ' A' ' 24' ' ' ILE . 45.1 mtt -69.36 -65.87 0.66 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.472 -0.767 . . . . 0.0 110.38 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 88.7 m95 -68.88 -16.09 63.67 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.442 -0.786 . . . . 0.0 112.861 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -93.08 -0.93 56.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 112.275 -177.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -111.03 22.24 15.51 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.998 -1.064 . . . . 0.0 110.751 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.726 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 74.01 55.5 5.77 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.726 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.6 mp -123.61 -168.68 1.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.546 -0.973 . . . . 0.0 109.261 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.508 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -177.94 116.47 0.54 Allowed Glycine 0 N--CA 1.497 2.756 0 C-N-CA 119.701 -1.238 . . . . 0.0 112.175 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.436 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 30.6 -79.33 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.976 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -45.62 -54.6 7.46 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.485 -0.759 . . . . 0.0 109.435 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.536 ' CE1' ' HB ' ' A' ' 27' ' ' THR . 21.2 t-80 -76.64 -32.64 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.623 HD11 ' HB2' ' A' ' 19' ' ' LEU . 16.9 mm -70.67 0.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 121.428 -0.795 . . . . 0.0 110.676 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.408 ' CB ' ' N ' ' A' ' 32' ' ' ARG . 51.9 p -138.19 -0.27 2.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.976 -1.077 . . . . 0.0 111.958 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -117.3 -39.7 3.16 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 120.891 -1.131 . . . . 0.0 108.312 -179.231 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.536 ' HB ' ' CE1' ' A' ' 23' ' ' HIS . 59.9 m -90.53 -27.43 19.18 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.607 -0.683 . . . . 0.0 109.182 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.443 ' HG3' ' CG ' ' A' ' 14' ' ' MET . 4.0 mmm -81.38 -125.79 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.435 ' H ' HD13 ' A' ' 30' ' ' ILE . 4.1 m120 -143.26 26.67 1.63 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 121.265 1.848 . . . . 0.0 113.364 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -156.49 -177.16 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.676 -1.265 . . . . 0.0 110.952 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.962 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -87.71 152.57 22.04 Favored 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.408 ' N ' ' CB ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -63.85 -39.9 95.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.188 -0.945 . . . . 0.0 112.178 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.6 t -61.7 -44.37 97.07 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.187 -0.946 . . . . 0.0 109.084 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.7 m -62.69 -35.65 80.4 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 122.121 0.962 . . . . 0.0 108.583 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.976 HG12 HD11 ' A' ' 39' ' ' ILE . 43.9 t -63.99 -30.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.717 ' HA ' HD12 ' A' ' 39' ' ' ILE . 7.1 m-85 -75.99 -20.35 57.93 Favored 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 119.81 -0.756 . . . . 0.0 110.413 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -63.18 -37.37 86.97 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 11' ' ' VAL . 2.3 t -77.82 -54.13 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.605 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.976 HD11 HG12 ' A' ' 35' ' ' VAL . 6.8 mt -55.03 -33.02 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.306 -0.871 . . . . 0.0 109.838 -177.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.45 -39.71 62.37 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -97.94 23.65 7.82 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.906 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.493 1.682 0 O-C-N 121.45 -0.781 . . . . 0.0 109.49 179.984 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.35 0.595 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.68 -30.86 71.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 109.325 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.9 -53.18 58.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.582 -0.699 . . . . 0.0 109.303 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 38' ' ' VAL . 32.4 t -61.01 -30.9 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.555 -0.716 . . . . 0.0 109.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 6.7 tp -58.98 -35.69 73.63 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.703 -0.623 . . . . 0.0 109.64 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -85.82 -16.6 38.2 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.521 -0.737 . . . . 0.0 110.465 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.656 ' HE2' HG13 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -67.3 -48.71 66.82 Favored 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.363 -0.836 . . . . 0.0 110.846 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.566 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 92.6 m95 -102.41 -30.86 10.77 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.557 -1.339 . . . . 0.0 112.315 -178.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.41 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.6 mm-40 -71.34 -22.43 61.91 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -177.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' CD1' ' A' ' 19' ' ' LEU . 94.0 mt-30 -80.27 -32.37 38.23 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.332 -0.855 . . . . 0.0 109.098 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.77 63.97 0.43 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.918 ' HB2' HG23 ' A' ' 24' ' ' ILE . 2.5 mp -122.47 -178.94 4.04 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.41 -1.053 . . . . 0.0 109.98 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.462 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -152.09 118.62 0.91 Allowed Glycine 0 N--CA 1.496 2.691 0 C-N-CA 119.974 -1.107 . . . . 0.0 111.515 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.678 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 32.99 -86.02 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t -67.1 -52.13 45.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.263 -0.898 . . . . 0.0 110.577 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.651 ' ND1' HD23 ' A' ' 19' ' ' LEU . 51.3 t-80 -58.87 -38.92 79.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.534 -0.729 . . . . 0.0 110.04 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.918 HG23 ' HB2' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -57.29 -35.3 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.582 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 30' ' ' ILE . 23.1 t -68.53 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.114 0.483 . . . . 0.0 109.848 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -27.61 65.1 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.55 ' OG1' HD21 ' A' ' 19' ' ' LEU . 46.1 m -90.43 -67.22 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.466 -0.771 . . . . 0.0 111.162 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -92.82 23.87 3.93 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.209 -0.932 . . . . 0.0 111.597 -178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 36.48 84.37 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 177.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.925 HD13 HG21 ' A' ' 35' ' ' VAL . 0.8 OUTLIER -160.25 145.7 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.366 -0.833 . . . . 0.0 109.585 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.636 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -60.3 149.31 33.88 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.208 -0.933 . . . . 0.0 109.102 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.584 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 35.0 ptt180 -74.26 -41.15 61.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.244 -0.91 . . . . 0.0 111.948 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.45 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -67.14 -44.1 80.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 108.544 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.9 m -59.4 -40.08 85.45 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.8 1.286 . . . . 0.0 107.992 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.925 HG21 HD13 ' A' ' 30' ' ' ILE . 5.8 t -60.09 -37.26 72.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.648 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.7 m-85 -67.64 -23.27 65.32 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.997 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -62.96 -35.35 79.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 11' ' ' VAL . 58.7 t -69.87 -60.57 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.664 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 ' O ' ' A' ' 35' ' ' VAL . 2.1 mp -54.99 -31.56 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 CA-C-O 121.718 0.77 . . . . 0.0 109.939 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -67.07 -42.64 84.35 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -100.67 25.22 8.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.731 -0.605 . . . . 0.0 109.701 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 N--CA 1.493 1.704 0 O-C-N 121.471 -0.768 . . . . 0.0 109.577 -179.911 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 121.181 0.515 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -70.23 -29.11 65.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.536 -0.727 . . . . 0.0 109.811 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.57 ' HB1' ' SD ' ' A' ' 28' ' ' MET . . . -59.02 -46.57 87.88 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.418 -0.801 . . . . 0.0 109.833 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.552 HG12 ' HD1' ' A' ' 15' ' ' TRP . 38.3 t -62.48 -48.53 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 109.052 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.56 -15.9 59.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.72 -0.612 . . . . 0.0 110.503 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -77.46 -43.52 32.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.924 -1.11 . . . . 0.0 110.409 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.949 ' CB ' HG23 ' A' ' 24' ' ' ILE . 27.0 mmt -77.99 -48.75 15.51 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.341 -0.85 . . . . 0.0 111.093 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.843 ' NE1' HD11 ' A' ' 39' ' ' ILE . 83.5 m95 -63.69 -47.4 81.31 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.821 -1.175 . . . . 0.0 111.491 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -67.81 -36.55 80.61 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.88 -0.513 . . . . 0.0 110.854 -177.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -63.05 -24.0 67.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.278 -0.889 . . . . 0.0 109.944 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.47 62.45 0.57 Allowed Glycine 0 N--CA 1.496 2.662 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.915 HD23 ' CD2' ' A' ' 23' ' ' HIS . 2.1 mp -130.72 -172.98 2.95 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.648 -0.913 . . . . 0.0 110.063 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -140.93 129.4 4.08 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.793 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . -15.27 -44.86 0.0 OUTLIER 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 124.837 1.255 . . . . 0.0 114.021 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.3 m -48.84 -74.03 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.282 -0.886 . . . . 0.0 109.81 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.915 ' CD2' HD23 ' A' ' 19' ' ' LEU . 1.3 p-80 -85.98 2.64 45.47 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 121.271 -0.893 . . . . 0.0 111.332 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.949 HG23 ' CB ' ' A' ' 14' ' ' MET . 20.6 mt -75.3 -37.29 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 177.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.404 ' HA ' HG13 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -91.6 -26.95 18.46 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.7 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -42.44 82.83 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.371 -0.831 . . . . 0.0 109.007 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.3 m -79.39 -45.34 19.7 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.57 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.33 110.46 22.22 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.179 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 12.3 m120 -37.96 89.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.829 HD12 HG22 ' A' ' 35' ' ' VAL . 1.1 pt -179.46 176.2 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -98.8 162.66 12.98 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.307 -0.87 . . . . 0.0 109.13 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.793 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 28.4 ptt180 -77.5 -38.3 49.29 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.2 -0.937 . . . . 0.0 110.607 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.437 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -73.7 -39.45 64.34 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.1 m -61.07 -39.69 90.86 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.596 1.189 . . . . 0.0 107.829 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.829 HG22 HD12 ' A' ' 30' ' ' ILE . 14.0 t -61.01 -41.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 5.1 m-85 -68.4 -19.76 64.63 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.845 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -59.76 -37.37 78.84 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.38 -56.65 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.325 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.843 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.5 mm -52.21 -31.47 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 CA-C-O 121.796 0.808 . . . . 0.0 110.581 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -74.07 -41.82 61.13 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -96.7 23.51 6.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.795 -0.566 . . . . 0.0 109.851 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.435 -0.791 . . . . 0.0 109.451 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 . . . . . 0 N--CA 1.502 2.159 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.92 -23.8 61.7 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.955 -1.091 . . . . 0.0 110.154 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -47.5 76.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.8 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.767 HG11 ' CG1' ' A' ' 38' ' ' VAL . 74.7 t -64.52 -57.89 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.2 tt -53.4 -23.23 9.2 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.827 -0.546 . . . . 0.0 110.952 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -72.59 -40.01 66.92 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.395 -0.816 . . . . 0.0 110.396 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.823 ' CB ' HG23 ' A' ' 24' ' ' ILE . 11.4 mmt -67.72 -45.43 75.05 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.433 -0.792 . . . . 0.0 111.682 -178.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.917 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 62.9 m95 -70.61 -27.57 64.18 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.121 -0.987 . . . . 0.0 110.577 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -81.83 -18.66 43.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.483 -0.761 . . . . 0.0 110.432 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.537 ' HB2' HD22 ' A' ' 19' ' ' LEU . 4.2 mm100 -85.09 -31.43 23.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.0 109.681 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.24 -0.61 7.05 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.625 HD23 ' HA ' ' A' ' 14' ' ' MET . 0.4 OUTLIER -62.42 -176.48 0.11 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.111 -1.229 . . . . 0.0 109.906 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -155.24 121.5 1.11 Allowed Glycine 0 N--CA 1.494 2.526 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.262 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.822 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 20.57 -80.46 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 178.193 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.412 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.3 t -44.45 -59.91 2.2 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.535 -0.728 . . . . 0.0 111.089 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.489 ' CD2' ' HG ' ' A' ' 19' ' ' LEU . 5.9 t60 -67.38 -40.07 85.69 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.451 -0.781 . . . . 0.0 109.251 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.823 HG23 ' CB ' ' A' ' 14' ' ' MET . 62.8 mt -69.12 -7.91 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.517 -0.739 . . . . 0.0 111.045 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.411 ' HB3' ' N ' ' A' ' 31' ' ' ALA . 10.1 m -113.92 -71.78 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.477 -0.764 . . . . 0.0 111.266 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -38.72 73.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.851 -1.155 . . . . 0.0 110.29 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.618 HG22 ' CE ' ' A' ' 28' ' ' MET . 13.0 m -93.16 -27.17 17.06 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.963 -0.695 . . . . 0.0 111.969 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.618 ' CE ' HG22 ' A' ' 27' ' ' THR . 13.8 mmt -118.08 -42.71 2.79 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.058 -1.026 . . . . 0.0 112.049 -177.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.6 m-80 -119.52 -93.5 0.52 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.887 -1.133 . . . . 0.0 111.473 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.771 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 175.2 114.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 O-C-N 121.135 -0.978 . . . . 0.0 109.438 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.411 ' N ' ' HB3' ' A' ' 25' ' ' SER . . . 61.58 143.63 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.395 -0.816 . . . . 0.0 110.042 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.822 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -82.61 -45.85 14.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.067 -1.021 . . . . 0.0 111.873 -178.441 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.423 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 59.4 p -62.41 -42.42 99.43 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.126 -0.983 . . . . 0.0 108.526 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.2 m -63.43 -49.68 72.79 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 39' ' ' ILE . 2.7 t -56.92 -22.08 15.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.368 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.872 ' CD1' HD12 ' A' ' 39' ' ' ILE . 1.1 m-85 -75.79 -36.33 59.81 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.897 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -55.39 -36.34 66.29 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.767 ' CG1' HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -64.38 -50.23 77.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.824 179.236 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.917 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 5.0 mt -57.4 -38.36 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-O 121.537 0.684 . . . . 0.0 109.946 -177.058 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.49 -39.15 92.55 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -63.35 -29.55 70.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.823 -0.548 . . . . 0.0 109.642 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.563 -0.711 . . . . 0.0 109.797 -179.916 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 121.211 0.529 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -63.43 -24.8 67.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.496 -0.752 . . . . 0.0 109.86 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -44.82 95.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.43 -0.793 . . . . 0.0 109.827 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 38' ' ' VAL . 87.0 t -62.8 -50.27 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.341 -0.849 . . . . 0.0 108.998 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 12' ' ' LEU . 3.6 tt -56.36 -29.42 61.37 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.896 -0.502 . . . . 0.0 110.678 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -70.34 -33.83 71.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.455 -0.778 . . . . 0.0 110.098 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.641 ' HB3' HG22 ' A' ' 24' ' ' ILE . 30.7 mmt -65.3 -47.98 74.71 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.561 -0.712 . . . . 0.0 110.007 -179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 1.007 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 78.9 m95 -62.42 -33.2 74.32 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.11 -0.994 . . . . 0.0 110.177 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -63.35 -22.19 66.73 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.684 -0.635 . . . . 0.0 110.742 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.61 22.54 4.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.357 -0.839 . . . . 0.0 110.35 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.06 54.85 10.27 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.809 ' HB3' HG23 ' A' ' 24' ' ' ILE . 4.8 mp -110.01 162.97 14.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.551 -0.97 . . . . 0.0 110.455 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.488 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -154.35 119.17 0.91 Allowed Glycine 0 N--CA 1.499 2.87 0 C-N-CA 120.031 -1.08 . . . . 0.0 111.721 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.669 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 31.39 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.465 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.0 m -66.1 -53.69 34.92 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.315 -0.866 . . . . 0.0 110.696 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -58.28 -32.78 68.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.587 -0.696 . . . . 0.0 110.169 -179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.809 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -67.03 -36.73 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.892 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 179.038 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 t -59.81 -28.46 67.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.505 -0.747 . . . . 0.0 109.429 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.59 -51.84 60.67 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.6 m -75.12 -71.39 0.36 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.619 ' SD ' HD11 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -78.14 96.18 5.11 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 177.681 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.535 ' C ' HD13 ' A' ' 30' ' ' ILE . 5.4 m-20 -59.92 83.83 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.499 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.619 HD11 ' SD ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -156.34 174.44 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.251 -0.905 . . . . 0.0 109.484 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -74.71 141.66 44.47 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.451 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 3.2 ppt_? -70.56 -38.76 74.18 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.076 -178.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 p -64.49 -40.78 96.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.995 -1.065 . . . . 0.0 108.814 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.2 m -64.17 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 31' ' ' ALA . 71.3 t -59.88 -29.99 44.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.882 ' CD1' HD12 ' A' ' 39' ' ' ILE . 2.9 m-85 -72.12 -31.42 66.01 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.976 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -36.79 68.42 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.383 1.087 . . . . 0.0 108.206 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -68.6 -55.49 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.073 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 1.007 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 1.1 mt -54.65 -45.01 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 121.93 0.871 . . . . 0.0 109.478 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -60.56 -39.1 86.72 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -64.13 -28.9 70.09 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.274 -0.571 . . . . 0.0 109.626 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.539 -0.725 . . . . 0.0 109.502 179.989 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -64.01 -24.56 67.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.611 -0.681 . . . . 0.0 109.92 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.95 -52.11 65.37 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.359 -0.838 . . . . 0.0 109.71 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 38' ' ' VAL . 22.2 t -60.61 -34.83 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.6 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.842 HD23 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -61.2 -39.06 88.8 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.783 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -66.98 -26.31 66.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.419 -0.801 . . . . 0.0 109.981 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.872 ' SD ' HD11 ' A' ' 30' ' ' ILE . 3.2 mtm -67.4 -67.08 0.48 Allowed 'General case' 0 C--N 1.306 -1.288 0 O-C-N 121.345 -0.847 . . . . 0.0 111.146 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.586 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 90.0 m95 -66.23 -40.03 89.99 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.087 -1.008 . . . . 0.0 112.081 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.842 ' HG3' HD23 ' A' ' 12' ' ' LEU . 14.8 mm100 -59.29 -20.83 57.58 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.662 -0.649 . . . . 0.0 110.815 -177.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -89.47 -27.33 20.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.324 -0.86 . . . . 0.0 109.75 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.72 68.84 0.55 Allowed Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.231 -1.548 . . . . 0.0 109.231 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.906 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -120.9 162.61 19.55 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.626 -0.926 . . . . 0.0 109.995 -178.979 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.5 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -136.22 118.92 1.9 Allowed Glycine 0 N--CA 1.5 2.937 0 C-N-CA 120.264 -0.969 . . . . 0.0 111.586 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.715 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 31.22 -85.36 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 179.031 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 t -67.68 -53.11 30.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.3 -0.875 . . . . 0.0 110.55 -178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 -59.06 -26.49 64.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.595 -0.691 . . . . 0.0 110.551 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.906 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.92 -36.44 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.889 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 179.402 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -64.41 -40.9 96.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.718 -0.614 . . . . 0.0 110.105 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -60.72 -34.4 74.35 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.475 -0.765 . . . . 0.0 109.926 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.4 m -71.25 -58.49 3.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.517 -0.739 . . . . 0.0 109.947 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.42 ' HB2' ' CE ' ' A' ' 14' ' ' MET . 23.9 mmt -104.61 -140.83 0.36 Allowed 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.718 ' O ' HG23 ' A' ' 30' ' ' ILE . 1.4 t-20 -137.48 88.21 2.32 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.332 -1.48 . . . . 0.0 111.82 -178.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.891 HD13 HG22 ' A' ' 35' ' ' VAL . 1.1 pp -168.29 153.49 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 O-C-N 121.234 -0.916 . . . . 0.0 110.39 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.821 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -71.69 167.04 20.69 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.715 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 7.1 ppt_? -64.26 -41.47 96.94 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.236 -0.915 . . . . 0.0 111.529 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.04 -30.22 58.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.163 -0.96 . . . . 0.0 108.953 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.3 m -63.93 -34.66 78.47 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.891 HG22 HD13 ' A' ' 30' ' ' ILE . 2.5 t -63.58 -45.03 98.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' HA ' HD12 ' A' ' 39' ' ' ILE . 14.4 m-85 -62.94 -16.71 60.27 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 120.156 -0.618 . . . . 0.0 111.498 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.4 -39.1 85.56 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 175.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 11' ' ' VAL . 66.3 t -71.49 -60.91 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.034 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.803 HD11 HG12 ' A' ' 35' ' ' VAL . 1.8 mp -55.67 -32.98 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 CA-C-O 121.758 0.79 . . . . 0.0 109.63 -176.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -65.54 -41.68 92.8 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.19 -34.08 76.86 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.714 -0.616 . . . . 0.0 109.476 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.54 -0.725 . . . . 0.0 109.793 179.957 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 12' ' ' LEU . 31.2 mmt180 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 120.785 0.326 . . . . 0.0 110.232 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.42 -33.93 73.71 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.284 -0.885 . . . . 0.0 109.674 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.11 72.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.558 -0.714 . . . . 0.0 109.773 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.61 HG12 ' HD1' ' A' ' 15' ' ' TRP . 10.6 t -76.94 -32.34 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 8' ' ' ARG . 0.9 OUTLIER -63.04 -22.74 67.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.469 -0.77 . . . . 0.0 109.427 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -83.5 -45.83 13.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.102 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.701 ' O ' HG23 ' A' ' 24' ' ' ILE . 24.0 ptp -71.03 -3.82 21.68 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.508 -0.745 . . . . 0.0 111.486 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.61 ' HD1' HG12 ' A' ' 11' ' ' VAL . 33.5 m95 -120.57 -42.46 2.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.463 -1.398 . . . . 0.0 111.22 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -78.7 0.67 25.75 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.382 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -103.77 22.71 13.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.097 -1.002 . . . . 0.0 110.041 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.504 ' O ' HD12 ' A' ' 19' ' ' LEU . . . 76.59 63.55 2.32 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.504 HD12 ' O ' ' A' ' 18' ' ' GLY . 0.8 OUTLIER -127.41 160.3 31.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.742 -0.858 . . . . 0.0 110.452 -178.679 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.439 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.5 125.23 1.41 Allowed Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.01 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.5 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 30.1 -84.41 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.1 t -63.92 -52.03 61.7 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.267 -0.896 . . . . 0.0 111.161 -177.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.429 ' HA ' ' NZ ' ' A' ' 26' ' ' LYS . 58.5 t-80 -61.49 -30.72 70.79 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.446 -0.783 . . . . 0.0 109.834 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.701 HG23 ' O ' ' A' ' 14' ' ' MET . 0.2 OUTLIER -77.26 -24.36 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.942 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.778 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.9 t -58.52 -48.32 81.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.966 -1.083 . . . . 0.0 110.319 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.429 ' NZ ' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -73.9 -36.72 64.78 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.531 -179.239 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.0 m -62.12 -69.56 0.24 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.35 -0.843 . . . . 0.0 109.759 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.439 ' HE1' HG22 ' A' ' 35' ' ' VAL . 1.5 ptt? -80.07 -134.73 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.467 ' O ' HG23 ' A' ' 30' ' ' ILE . 36.2 m-20 -157.69 45.31 0.35 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.368 -1.458 . . . . 0.0 113.1 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.467 HG23 ' O ' ' A' ' 29' ' ' ASN . 14.3 pt -154.25 166.6 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.958 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.426 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -57.21 162.48 2.64 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 110.404 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -72.55 -33.88 67.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.757 -0.589 . . . . 0.0 111.645 -178.825 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.476 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 12.3 p -74.78 -35.54 62.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.022 -1.048 . . . . 0.0 108.775 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 73.7 m -61.26 -33.22 73.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.473 ' C ' HD12 ' A' ' 39' ' ' ILE . 0.5 OUTLIER -65.86 -40.89 88.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.844 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 39' ' ' ILE . 12.3 m-85 -67.03 -13.77 62.24 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 119.421 -0.911 . . . . 0.0 110.981 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -69.05 -40.23 78.67 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.16 -1.792 . . . . 0.0 106.16 174.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.48 HG11 HG21 ' A' ' 11' ' ' VAL . 2.3 t -77.87 -56.06 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.282 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 36' ' ' TYR . 4.2 mt -54.17 -34.12 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.407 -0.808 . . . . 0.0 109.316 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.33 -40.96 73.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -60.98 -30.29 70.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.703 -0.623 . . . . 0.0 109.795 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.494 1.772 0 O-C-N 121.93 -0.482 . . . . 0.0 109.827 -179.929 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.726 ' NH2' HD12 ' A' ' 12' ' ' LEU . 7.9 ptt180 . . . . . 0 N--CA 1.507 2.394 0 CA-C-O 121.229 0.537 . . . . 0.0 111.772 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.69 -28.67 61.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.336 -0.852 . . . . 0.0 109.564 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.06 -54.84 5.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.546 -0.721 . . . . 0.0 110.029 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 38' ' ' VAL . 19.0 t -58.78 -40.19 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 109.176 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.726 HD12 ' NH2' ' A' ' 8' ' ' ARG . 5.5 tt -59.2 -39.07 81.48 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -57.44 -33.85 68.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.446 -0.784 . . . . 0.0 109.079 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.902 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.3 mmt -62.59 -45.92 90.65 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.827 -0.546 . . . . 0.0 109.655 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.979 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 32.8 m95 -79.54 -0.27 32.73 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.171 -0.955 . . . . 0.0 111.079 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.58 ' HG3' HD23 ' A' ' 12' ' ' LEU . 7.9 mm100 -100.33 -21.5 15.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.962 -1.086 . . . . 0.0 111.321 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.431 ' HB2' HD11 ' A' ' 19' ' ' LEU . 94.4 mm-40 -95.62 10.61 36.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.133 -0.98 . . . . 0.0 111.362 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.564 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 84.24 65.58 1.52 Allowed Glycine 0 N--CA 1.496 2.642 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.851 HD13 ' O ' ' A' ' 14' ' ' MET . 7.4 mp -124.18 -172.59 2.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.668 -0.901 . . . . 0.0 109.309 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -164.62 120.87 0.97 Allowed Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.002 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.562 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 17.38 -72.45 0.0 OUTLIER 'General case' 0 N--CA 1.522 3.163 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 20' ' ' GLY . 41.6 m -50.61 -59.98 3.5 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.118 -0.989 . . . . 0.0 110.361 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.621 ' O ' HG22 ' A' ' 27' ' ' THR . 17.4 t-80 -65.65 -38.42 89.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.392 -0.818 . . . . 0.0 109.341 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.902 HG23 ' HB3' ' A' ' 14' ' ' MET . 38.6 mt -72.96 -7.23 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.609 -0.682 . . . . 0.0 110.36 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.454 ' OG ' HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -87.21 -68.62 0.74 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.545 -0.722 . . . . 0.0 110.054 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.758 ' HA ' HG22 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -55.5 -26.17 41.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.623 -0.673 . . . . 0.0 110.685 -179.353 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.621 HG22 ' O ' ' A' ' 23' ' ' HIS . 12.8 t -85.67 -36.57 20.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.495 -0.753 . . . . 0.0 109.942 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.733 ' HG2' HG22 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -141.17 112.89 7.66 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -178.549 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.781 ' O ' HG22 ' A' ' 35' ' ' VAL . 4.3 t-20 40.35 90.08 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.707 -0.621 . . . . 0.0 111.862 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.758 HG22 ' HA ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -58.02 -162.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.679 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.971 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 63.38 105.47 0.03 OUTLIER 'General case' 0 C--O 1.193 -1.876 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.436 ' CD ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 mtm180 -57.62 -52.83 63.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.686 -0.634 . . . . 0.0 111.66 -176.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -57.78 -40.98 81.11 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.112 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 88.3 m -67.57 -31.75 72.03 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.952 0.882 . . . . 0.0 108.938 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.971 HG23 ' O ' ' A' ' 31' ' ' ALA . 89.1 t -66.69 -31.19 52.4 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.89 ' CD1' HD12 ' A' ' 39' ' ' ILE . 16.2 m-85 -76.25 -23.02 54.46 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.368 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -37.85 84.12 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 11' ' ' VAL . 1.3 t -67.94 -52.72 36.35 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.344 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.979 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 4.5 mt -58.43 -36.65 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-O 121.819 0.819 . . . . 0.0 110.052 -176.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -66.05 -36.98 84.71 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -57.15 -21.31 31.8 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.723 -0.611 . . . . 0.0 110.117 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.496 1.843 0 O-C-N 121.349 -0.845 . . . . 0.0 109.949 179.744 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.085 0.469 . . . . 0.0 109.85 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.06 -26.3 66.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.519 -0.738 . . . . 0.0 110.163 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.739 ' HB1' ' SD ' ' A' ' 28' ' ' MET . . . -62.79 -53.07 59.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.467 -0.771 . . . . 0.0 109.915 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.899 HG11 ' CG1' ' A' ' 38' ' ' VAL . 45.4 t -59.43 -34.6 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.287 -0.883 . . . . 0.0 109.387 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 16.1 mt -65.27 -33.48 76.07 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -66.56 -31.02 71.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.164 -0.96 . . . . 0.0 110.562 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.948 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.4 mtm -70.51 -61.04 1.92 Allowed 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.278 -0.889 . . . . 0.0 111.372 -178.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 97.7 m95 -76.33 -42.01 46.49 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.295 -0.878 . . . . 0.0 112.963 -176.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 7.9 mm100 -63.25 -26.42 68.77 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.599 -0.688 . . . . 0.0 110.489 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -78.38 -24.41 46.37 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.311 -0.868 . . . . 0.0 109.807 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.12 63.13 0.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.831 HD12 ' O ' ' A' ' 14' ' ' MET . 8.4 mt -119.51 -173.63 2.56 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.932 . . . . 0.0 110.831 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -145.45 116.51 0.91 Allowed Glycine 0 N--CA 1.498 2.832 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.469 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.705 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 10.1 -65.35 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.3 1.592 . . . . 0.0 115.3 178.413 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.5 m -45.61 -57.44 4.18 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.07 -1.019 . . . . 0.0 110.826 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.863 ' CE1' HG21 ' A' ' 27' ' ' THR . 13.8 t-80 -81.52 -31.0 33.0 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.392 -0.818 . . . . 0.0 109.365 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.948 HG23 ' HB3' ' A' ' 14' ' ' MET . 67.8 mt -61.82 -21.99 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.298 -0.876 . . . . 0.0 110.613 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 p -109.05 -54.45 2.53 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.307 -0.871 . . . . 0.0 110.596 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -24.86 65.1 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.434 -0.791 . . . . 0.0 110.235 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.863 HG21 ' CE1' ' A' ' 23' ' ' HIS . 18.4 m -86.4 -57.01 3.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.453 -0.779 . . . . 0.0 109.828 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.739 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -65.66 -101.97 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.572 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 30' ' ' ILE . 25.7 t-20 -163.58 64.66 0.17 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.551 -1.343 . . . . 0.0 111.039 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.764 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.7 OUTLIER -176.43 -175.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 O-C-N 121.084 -1.01 . . . . 0.0 110.075 179.471 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.936 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -97.83 170.64 8.83 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.55 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -64.4 -46.67 82.26 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 0.0 111.703 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 1.0 OUTLIER -67.88 -36.25 79.92 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.206 -0.934 . . . . 0.0 108.753 -179.605 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.6 m -61.06 -35.23 76.39 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.938 HG12 HD11 ' A' ' 39' ' ' ILE . 12.2 t -64.17 -34.22 67.46 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.309 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 39' ' ' ILE . 13.4 m-85 -75.28 -15.36 60.52 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.397 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.28 -39.42 86.01 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.899 ' CG1' HG11 ' A' ' 11' ' ' VAL . 2.1 t -74.47 -55.01 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.237 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.938 HD11 HG12 ' A' ' 35' ' ' VAL . 6.3 mt -56.03 -33.28 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.407 -0.808 . . . . 0.0 109.631 -177.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.17 -40.6 82.27 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -63.48 -28.1 69.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.79 -0.569 . . . . 0.0 109.586 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.495 1.805 0 O-C-N 121.441 -0.787 . . . . 0.0 109.584 -179.96 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.83 -29.14 60.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.515 -0.74 . . . . 0.0 109.703 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.15 -59.05 3.52 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.579 -0.701 . . . . 0.0 109.678 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.424 HG11 HG11 ' A' ' 38' ' ' VAL . 46.0 t -60.87 -38.4 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.564 -0.71 . . . . 0.0 109.626 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 12' ' ' LEU . 31.9 mt -70.98 -21.72 62.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 110.359 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -71.74 -47.4 54.03 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.999 -1.063 . . . . 0.0 110.709 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.746 ' SD ' HD13 ' A' ' 30' ' ' ILE . 12.7 ptp -73.32 -48.21 36.26 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.295 -0.878 . . . . 0.0 112.339 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.752 ' NE1' HD11 ' A' ' 39' ' ' ILE . 75.3 m95 -65.57 -49.83 67.36 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.653 -1.279 . . . . 0.0 111.686 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 mm-40 -62.81 -25.8 68.43 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.901 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -71.33 -29.57 65.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.315 -0.866 . . . . 0.0 109.114 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.26 50.84 0.21 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HG23 ' A' ' 24' ' ' ILE . 1.7 mp -112.07 168.96 9.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.589 -0.948 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.479 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -153.67 117.76 0.82 Allowed Glycine 0 N--CA 1.498 2.805 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.851 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 34.94 -86.6 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -70.96 -51.65 24.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.174 -0.954 . . . . 0.0 110.236 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -57.39 -30.49 64.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.607 -0.683 . . . . 0.0 110.142 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.768 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -65.43 -39.7 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.752 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.53 -32.42 68.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.703 -0.623 . . . . 0.0 109.84 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -43.78 98.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.573 -0.704 . . . . 0.0 109.162 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.765 ' OG1' HD21 ' A' ' 19' ' ' LEU . 6.4 m -74.1 -66.58 0.7 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.547 -0.72 . . . . 0.0 109.414 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' ILE . 3.4 mtm -117.14 109.97 17.59 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -45.35 102.53 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.706 -0.621 . . . . 0.0 112.063 -178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 1.046 HD12 HG21 ' A' ' 35' ' ' VAL . 35.7 pt -143.79 159.4 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.64 -0.663 . . . . 0.0 109.9 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.749 ' HB3' ' HB ' ' A' ' 34' ' ' THR . . . -85.51 150.75 24.46 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.661 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 33.5 ptt180 -77.57 -46.48 22.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.914 -1.116 . . . . 0.0 111.893 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 47.2 p -71.49 -39.1 71.06 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.18 -0.95 . . . . 0.0 108.577 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.749 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 85.9 m -59.78 -46.84 87.95 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.465 1.126 . . . . 0.0 108.804 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 1.046 HG21 HD12 ' A' ' 30' ' ' ILE . 27.3 t -60.08 -38.68 77.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.454 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.8 m-85 -69.01 -18.94 64.11 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.24 -178.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -61.28 -37.58 83.7 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 174.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.454 HG12 HD13 ' A' ' 39' ' ' ILE . 2.2 t -77.05 -49.13 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.818 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.752 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.6 mm -57.37 -37.61 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.884 -1.135 . . . . 0.0 110.086 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -68.82 -40.25 79.59 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.18 -14.41 62.26 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.838 -0.539 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.497 1.881 0 O-C-N 121.144 -0.973 . . . . 0.0 109.568 -179.914 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 121.049 0.452 . . . . 0.0 109.99 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.431 ' HA ' HD12 ' A' ' 12' ' ' LEU . 21.5 t70 -70.33 -23.95 62.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.413 -0.804 . . . . 0.0 109.88 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.75 -54.31 37.33 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 109.768 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.607 ' CB ' HG11 ' A' ' 38' ' ' VAL . 56.7 t -58.07 -39.91 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.471 -0.768 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 9' ' ' ASP . 95.6 mt -59.7 -37.75 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.68 -0.637 . . . . 0.0 109.777 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -65.87 -28.13 68.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.59 -0.693 . . . . 0.0 109.968 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.786 ' O ' HD22 ' A' ' 19' ' ' LEU . 25.4 mmt -63.97 -52.86 57.69 Favored 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.388 -0.82 . . . . 0.0 109.766 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.677 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 86.5 m95 -63.93 -31.81 73.12 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.257 -0.902 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -67.58 -18.87 65.15 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.804 -0.56 . . . . 0.0 110.713 -178.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -95.91 14.12 24.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.263 -0.898 . . . . 0.0 110.663 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.28 63.06 2.45 Favored Glycine 0 N--CA 1.495 2.611 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -118.43 153.98 33.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.697 -0.884 . . . . 0.0 110.293 -179.224 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -141.32 121.8 1.95 Allowed Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.349 -0.929 . . . . 0.0 110.961 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.656 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.18 -84.78 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.3 m -64.12 -54.14 38.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.334 -0.854 . . . . 0.0 111.097 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -60.15 -32.79 71.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.801 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -64.36 -32.68 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.076 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -69.93 -27.71 64.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.661 -0.65 . . . . 0.0 109.496 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -47.61 83.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.283 -0.886 . . . . 0.0 109.031 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -74.16 -64.1 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.577 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -98.98 98.06 9.15 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.017 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -52.15 89.26 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.664 -0.647 . . . . 0.0 112.334 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.47 HD12 ' O ' ' A' ' 28' ' ' MET . 0.1 OUTLIER -151.39 161.99 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.172 -0.955 . . . . 0.0 109.111 177.89 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.556 ' HB3' ' OG1' ' A' ' 34' ' ' THR . . . -72.41 158.83 35.02 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.341 -0.849 . . . . 0.0 109.429 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -67.84 -42.33 81.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.55 -0.719 . . . . 0.0 111.213 -179.06 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.426 ' N ' ' HD2' ' A' ' 32' ' ' ARG . 3.3 p -72.46 -32.84 66.58 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.064 -1.022 . . . . 0.0 108.37 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.556 ' OG1' ' HB3' ' A' ' 31' ' ' ALA . 89.6 m -62.23 -30.28 70.98 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.562 ' O ' HD12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -68.23 -40.54 82.88 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.664 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.646 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.716 ' HA ' HD12 ' A' ' 39' ' ' ILE . 20.3 m-85 -67.1 -11.98 58.7 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.762 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -74.58 -39.06 62.48 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.607 HG11 ' CB ' ' A' ' 11' ' ' VAL . 2.4 t -78.7 -54.38 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.147 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.716 HD12 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mt -55.69 -38.13 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.906 -177.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -66.04 -40.84 91.33 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -61.76 -28.89 69.77 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.708 -0.62 . . . . 0.0 109.754 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.5 -0.75 . . . . 0.0 109.528 -179.897 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -92.76 -73.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.563 -0.963 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.84 43.75 1.62 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.533 -0.729 . . . . 0.0 109.511 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -92.43 -79.65 0.38 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.486 -0.759 . . . . 0.0 109.508 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -114.56 78.38 1.15 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.43 -0.793 . . . . 0.0 109.455 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.4 ' O ' HD12 ' A' ' 6' ' ' ILE . 2.6 pp -153.79 147.39 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.456 -0.778 . . . . 0.0 109.575 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.14 170.46 10.61 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.616 -0.677 . . . . 0.0 109.335 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 179.36 -38.62 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.526 -0.734 . . . . 0.0 109.473 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -70.38 -24.6 62.98 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.948 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -67.19 0.42 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.426 -0.796 . . . . 0.0 109.997 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.633 HG21 HG11 ' A' ' 38' ' ' VAL . 20.7 t -65.45 -32.39 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.5 -0.75 . . . . 0.0 109.643 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.488 HD23 ' O ' ' A' ' 12' ' ' LEU . 8.7 tt -61.03 -22.49 64.61 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.588 -0.695 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -92.86 -44.05 8.68 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.825 ' O ' HD13 ' A' ' 19' ' ' LEU . 1.7 mpp? -61.69 -14.1 28.61 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.462 -0.774 . . . . 0.0 111.615 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.864 ' NE1' HD11 ' A' ' 39' ' ' ILE . 69.0 m95 -113.0 -42.72 3.51 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.725 -1.235 . . . . 0.0 110.869 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -75.64 -3.96 37.48 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.527 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -95.36 -29.3 14.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.089 -1.007 . . . . 0.0 109.519 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.94 75.94 0.42 Allowed Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.825 HD13 ' O ' ' A' ' 14' ' ' MET . 4.9 mp -133.25 -173.43 3.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.483 -1.01 . . . . 0.0 110.031 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.61 116.97 0.74 Allowed Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.03 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.651 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.01 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 22.0 t -61.76 -56.4 19.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 110.667 -178.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -57.92 -27.6 63.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.482 -0.761 . . . . 0.0 110.533 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.706 HG22 ' HE2' ' A' ' 28' ' ' MET . 0.3 OUTLIER -72.45 -39.01 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.806 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.65 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 99.1 p -65.2 -46.32 81.22 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.695 -0.628 . . . . 0.0 110.052 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -28.14 67.21 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.743 . . . . 0.0 109.829 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 m -79.32 -38.46 35.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.528 -0.732 . . . . 0.0 110.361 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.706 ' HE2' HG22 ' A' ' 24' ' ' ILE . 2.6 ptt? -110.27 -153.22 0.51 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.441 ' O ' HG23 ' A' ' 30' ' ' ILE . 8.4 p-10 -120.4 46.75 1.91 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.263 -0.898 . . . . 0.0 112.315 -177.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.684 ' CD1' HG22 ' A' ' 35' ' ' VAL . 15.4 pt -153.91 148.58 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 120.801 -1.187 . . . . 0.0 110.636 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.695 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -62.73 174.28 1.08 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.653 -0.654 . . . . 0.0 109.836 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.594 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -75.61 -41.48 54.33 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 111.662 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.411 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 4.9 t -68.93 -37.42 78.89 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.4 m -64.06 -37.3 86.93 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 31' ' ' ALA . 14.4 t -60.37 -41.2 86.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.7 m-85 -70.25 -18.42 63.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.973 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -59.98 -36.63 77.55 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 174.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 HG21 ' A' ' 11' ' ' VAL . 17.4 t -72.82 -57.44 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.449 178.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.864 HD11 ' NE1' ' A' ' 15' ' ' TRP . 6.0 mm -52.98 -31.35 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.837 0.827 . . . . 0.0 110.61 -176.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -74.34 -41.0 61.79 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -60.65 -33.31 72.63 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.709 -0.619 . . . . 0.0 109.796 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.8 m 59.57 29.8 19.39 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.49 -0.756 . . . . 0.0 109.725 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.491 179.997 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -90.76 -172.69 3.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.969 . . . . 0.0 109.488 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -84.6 90.61 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.68 . . . . 0.0 109.502 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -118.42 36.32 4.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.575 -0.703 . . . . 0.0 109.448 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.0 mtmt -99.73 -65.56 0.96 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.565 -0.71 . . . . 0.0 109.504 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.774 HG23 ' NH1' ' A' ' 8' ' ' ARG . 1.7 mp -88.16 74.43 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.35 79.65 1.4 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' HG23 ' A' ' 6' ' ' ILE . 1.4 mpp_? -97.48 32.94 2.12 Favored 'General case' 0 N--CA 1.483 1.194 0 O-C-N 121.607 -0.683 . . . . 0.0 109.709 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -22.67 65.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.559 -0.713 . . . . 0.0 109.976 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.94 -50.86 30.03 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.408 -0.807 . . . . 0.0 109.769 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.554 ' CG1' HG13 ' A' ' 35' ' ' VAL . 46.8 t -60.65 -44.65 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.504 -0.747 . . . . 0.0 109.429 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.555 HD13 ' OG ' ' A' ' 42' ' ' SER . 6.8 tp -63.55 -30.97 72.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.779 -0.576 . . . . 0.0 109.786 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -66.26 -30.71 71.2 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.377 -0.827 . . . . 0.0 110.142 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.511 ' O ' HD22 ' A' ' 19' ' ' LEU . 6.6 mmt -70.89 -56.48 6.18 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 121.429 -0.794 . . . . 0.0 110.285 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CE2' HG21 ' A' ' 24' ' ' ILE . 98.3 m95 -58.86 -40.03 83.12 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.318 -0.864 . . . . 0.0 111.494 -178.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -67.95 -16.31 64.0 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.823 -0.548 . . . . 0.0 111.891 -176.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.424 ' HB2' HD13 ' A' ' 19' ' ' LEU . 72.0 mt-30 -94.82 22.04 6.86 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.161 -0.962 . . . . 0.0 110.773 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.728 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 72.95 54.08 7.42 Favored Glycine 0 N--CA 1.5 2.939 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.728 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.5 mp -122.91 -170.8 2.17 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.924 . . . . 0.0 108.938 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.548 ' N ' HG12 ' A' ' 24' ' ' ILE . . . 178.39 116.13 0.48 Allowed Glycine 0 N--CA 1.499 2.864 0 C-N-CA 119.376 -1.392 . . . . 0.0 112.899 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.458 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 32.55 -78.98 0.0 OUTLIER 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 20' ' ' GLY . 29.6 t -44.16 -42.51 6.45 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.419 ' ND1' HD23 ' A' ' 19' ' ' LEU . 20.6 t-80 -94.57 -29.47 14.87 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 177.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.743 HG21 ' CE2' ' A' ' 15' ' ' TRP . 16.6 mm -76.19 8.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 121.217 -0.927 . . . . 0.0 110.762 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.7 m -137.4 -35.13 0.68 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.052 -1.03 . . . . 0.0 111.05 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.36 -36.22 16.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.833 -1.167 . . . . 0.0 110.305 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 32.2 m -91.39 -28.84 17.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.42 -0.8 . . . . 0.0 111.301 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.459 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -101.01 34.18 2.59 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.232 -0.917 . . . . 0.0 109.402 -178.657 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.518 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.9 p-10 33.95 58.64 0.59 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 177.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.799 HD12 ' CG2' ' A' ' 35' ' ' VAL . 6.0 pt -157.79 172.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.524 -0.735 . . . . 0.0 109.054 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -96.69 156.4 16.36 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.41 ' HG3' ' N ' ' A' ' 33' ' ' SER . 8.2 ptp180 -78.0 -45.93 22.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.848 -1.158 . . . . 0.0 111.53 -178.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -63.99 -42.25 97.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.11 -0.994 . . . . 0.0 108.943 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.2 m -63.68 -44.84 92.55 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 122.574 1.178 . . . . 0.0 108.236 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.926 HG12 HD11 ' A' ' 39' ' ' ILE . 12.0 t -63.4 -21.5 28.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' ILE . 2.1 m-85 -79.08 -24.54 43.43 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.21 -0.931 . . . . 0.0 110.137 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 mtpt -61.96 -37.45 84.8 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.86 -54.28 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.997 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.926 HD11 HG12 ' A' ' 35' ' ' VAL . 12.2 mt -53.99 -30.74 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 O-C-N 121.449 -0.782 . . . . 0.0 110.077 -178.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -72.69 -41.19 65.56 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.97 22.58 7.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.773 -0.579 . . . . 0.0 109.863 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.555 ' OG ' HD13 ' A' ' 12' ' ' LEU . 25.6 t -118.79 -39.58 2.95 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 109.423 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.448 -179.959 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -65.97 135.6 54.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.578 -0.954 . . . . 0.0 109.513 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.66 95.97 8.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.563 -0.71 . . . . 0.0 109.367 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.35 71.79 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.532 -0.73 . . . . 0.0 109.534 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -60.33 -27.31 67.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.342 -0.849 . . . . 0.0 109.953 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.542 HG22 ' N ' ' A' ' 7' ' ' ASP . 52.2 mt -61.41 165.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.558 -0.714 . . . . 0.0 109.59 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.542 ' N ' HG22 ' A' ' 6' ' ' ILE . 3.9 t70 -85.7 101.75 13.02 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -160.21 44.48 0.21 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.13 -23.33 62.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.626 -0.671 . . . . 0.0 109.972 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.798 ' HB1' ' HE1' ' A' ' 28' ' ' MET . . . -62.34 -55.74 25.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.388 -0.82 . . . . 0.0 109.731 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.607 HG22 ' SD ' ' A' ' 28' ' ' MET . 40.8 t -66.89 -42.1 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.493 -0.755 . . . . 0.0 109.285 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -26.45 61.85 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.567 -0.708 . . . . 0.0 109.946 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -86.8 -32.64 20.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.367 -0.833 . . . . 0.0 109.357 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.646 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -82.64 5.11 22.19 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.623 -0.673 . . . . 0.0 111.141 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.595 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 10.1 m95 -128.24 -49.47 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.386 1.089 . . . . 0.0 109.691 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.06 -15.25 61.51 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.008 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -80.16 -27.68 38.94 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.191 -0.943 . . . . 0.0 109.48 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.77 65.85 0.26 Allowed Glycine 0 N--CA 1.496 2.64 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.648 HD23 ' ND1' ' A' ' 23' ' ' HIS . 4.9 mp -127.98 -171.74 2.52 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.497 -1.002 . . . . 0.0 110.158 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.439 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -154.55 112.21 0.52 Allowed Glycine 0 N--CA 1.496 2.677 0 C-N-CA 119.647 -1.263 . . . . 0.0 111.777 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 16.25 -74.31 0.0 OUTLIER 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.4 p -48.65 -59.35 3.59 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.179 -0.951 . . . . 0.0 110.776 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.648 ' ND1' HD23 ' A' ' 19' ' ' LEU . 13.3 t-80 -64.93 -37.51 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.775 HD12 ' N ' ' A' ' 21' ' ' ALA . 78.8 mt -66.73 -14.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.813 -0.554 . . . . 0.0 110.283 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 p -81.18 -40.79 23.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 108.789 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' N ' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -66.18 -55.33 16.84 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.745 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.453 HG23 ' N ' ' A' ' 28' ' ' MET . 4.1 t -62.64 -48.24 80.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.638 -0.664 . . . . 0.0 109.461 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.798 ' HE1' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -107.44 93.57 4.62 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 178.506 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.735 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.0 t-20 -47.94 96.36 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.06 HD12 HG22 ' A' ' 35' ' ' VAL . 1.2 pt -172.01 147.95 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.955 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -61.27 155.92 19.92 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.808 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -64.31 -35.2 80.08 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.185 -0.947 . . . . 0.0 111.244 -178.361 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 86.9 p -75.42 -36.73 60.73 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.144 -0.973 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.7 m -61.8 -34.96 76.85 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 1.06 HG22 HD12 ' A' ' 30' ' ' ILE . 8.9 t -66.08 -34.79 72.61 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.39 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 39' ' ' ILE . 16.1 m-85 -75.25 -13.3 60.43 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.85 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -68.98 -38.4 79.3 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 174.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.4 HG11 HG11 ' A' ' 11' ' ' VAL . 2.1 t -76.7 -54.38 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.094 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.908 HD11 HG12 ' A' ' 35' ' ' VAL . 5.6 mt -56.07 -34.26 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.414 -0.804 . . . . 0.0 109.563 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' A' ' 36' ' ' TYR . 39.4 m-20 -69.79 -40.71 75.85 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -59.94 -28.75 67.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.923 -0.485 . . . . 0.0 109.773 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.2 m -68.28 -58.64 4.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.53 -0.731 . . . . 0.0 109.346 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.495 179.987 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -58.76 -22.69 58.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.488 -1.007 . . . . 0.0 110.404 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -73.61 -35.99 65.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.404 -0.81 . . . . 0.0 109.501 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.14 179.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.588 -0.695 . . . . 0.0 109.401 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.15 138.85 57.41 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.528 -0.733 . . . . 0.0 110.059 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 7' ' ' ASP . 2.4 pp -136.54 -174.74 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.546 -0.721 . . . . 0.0 109.547 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.674 ' O ' HD12 ' A' ' 6' ' ' ILE . 6.1 t0 -54.34 159.93 1.83 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.402 -0.811 . . . . 0.0 110.638 -179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.87 26.57 13.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.556 -0.715 . . . . 0.0 110.042 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -62.27 -31.05 71.57 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.521 -0.737 . . . . 0.0 109.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.53 -42.04 98.45 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.585 -0.697 . . . . 0.0 109.881 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 38' ' ' VAL . 45.8 t -62.6 -49.28 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.529 -0.732 . . . . 0.0 109.076 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.65 -8.71 57.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.733 -0.604 . . . . 0.0 110.486 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -77.65 -38.03 48.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.866 -1.147 . . . . 0.0 109.748 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.542 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.9 mmt -83.66 -45.26 13.64 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.495 -0.753 . . . . 0.0 110.45 -179.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CH2' HD11 ' A' ' 24' ' ' ILE . 35.0 m95 -55.14 -51.24 67.08 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.924 -1.11 . . . . 0.0 110.14 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -63.68 -28.27 69.79 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.472 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -73.89 -29.31 62.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.281 -0.887 . . . . 0.0 109.318 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.94 65.32 0.23 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.803 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -133.47 160.56 37.05 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.446 -1.032 . . . . 0.0 109.963 -179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.48 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -138.59 121.91 2.26 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.484 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 28.45 -83.4 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.5 t -64.43 -56.35 14.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.411 -0.806 . . . . 0.0 111.235 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.475 ' ND1' HD23 ' A' ' 19' ' ' LEU . 35.9 t-80 -57.04 -30.03 63.9 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.369 -0.832 . . . . 0.0 110.21 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.803 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.49 -34.61 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.7 p -62.78 -34.58 77.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.634 -0.666 . . . . 0.0 109.331 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -34.83 78.8 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.41 ' O ' ' HE3' ' A' ' 28' ' ' MET . 2.2 m -88.89 -76.42 0.4 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.823 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.436 ' HE2' ' HA ' ' A' ' 28' ' ' MET . 19.1 mmt -155.79 82.78 1.02 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.282 -0.886 . . . . 0.0 110.032 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.85 ' OD1' HG11 ' A' ' 35' ' ' VAL . 1.6 t-20 -152.74 -41.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.726 -1.234 . . . . 0.0 112.756 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER 50.75 145.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.915 0 CA-C-O 121.834 0.826 . . . . 0.0 112.359 -177.86 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.715 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 40.03 97.27 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.684 -0.635 . . . . 0.0 111.248 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.653 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -68.61 -42.53 77.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.969 -1.082 . . . . 0.0 112.535 -177.849 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 70.8 m -63.72 -43.9 95.18 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.045 -1.035 . . . . 0.0 108.845 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -63.1 -36.22 82.86 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.176 0.988 . . . . 0.0 108.617 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.895 HG12 HD11 ' A' ' 39' ' ' ILE . 38.0 t -65.2 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.736 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.6 m-85 -75.48 -21.0 58.43 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -64.18 -36.23 83.39 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 175.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 11' ' ' VAL . 3.2 t -74.41 -56.12 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.162 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.895 HD11 HG12 ' A' ' 35' ' ' VAL . 5.7 mt -55.53 -32.49 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.356 -0.84 . . . . 0.0 109.828 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -69.75 -40.4 76.15 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -62.73 -30.26 71.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.769 -0.582 . . . . 0.0 109.569 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.1 t -95.76 82.59 3.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.626 -0.671 . . . . 0.0 109.437 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.474 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -58.83 165.0 2.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.533 -0.981 . . . . 0.0 110.12 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -62.57 128.44 36.01 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.584 -0.697 . . . . 0.0 109.664 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -107.15 -77.85 0.59 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.615 -0.678 . . . . 0.0 109.304 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.46 168.3 19.52 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.319 -0.863 . . . . 0.0 109.828 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm 60.34 105.97 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.58 -0.7 . . . . 0.0 109.875 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -86.76 151.0 23.76 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.522 -0.736 . . . . 0.0 109.297 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -57.92 -37.62 74.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.487 -0.758 . . . . 0.0 109.986 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.17 -33.96 75.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.586 -0.696 . . . . 0.0 109.424 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.86 70.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.595 -0.69 . . . . 0.0 109.425 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 38' ' ' VAL . 47.0 t -65.35 -50.69 71.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.01 -23.81 67.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.669 -0.644 . . . . 0.0 109.718 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -63.28 -45.32 91.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.169 -0.957 . . . . 0.0 109.698 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 9.6 mmt -64.27 -43.11 95.84 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.463 -0.773 . . . . 0.0 110.025 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.651 ' CE2' HG21 ' A' ' 24' ' ' ILE . 80.0 m95 -67.78 -25.02 65.4 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.003 -1.061 . . . . 0.0 112.184 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -97.1 13.12 30.27 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.535 -0.728 . . . . 0.0 112.476 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.488 ' HB2' HD21 ' A' ' 19' ' ' LEU . 20.6 mm-40 -105.85 -22.25 12.97 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.073 -1.017 . . . . 0.0 110.562 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.44 -49.68 0.81 Allowed Glycine 0 N--CA 1.498 2.785 0 N-CA-C 108.42 -1.872 . . . . 0.0 108.42 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 1.124 HD12 HD13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -48.47 173.78 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 122.015 -0.697 . . . . 0.0 110.979 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.511 ' HA2' HG13 ' A' ' 24' ' ' ILE . . . -167.45 135.64 3.75 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.954 -1.117 . . . . 0.0 111.503 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.584 ' HB1' ' CB ' ' A' ' 32' ' ' ARG . . . 36.68 -83.41 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.442 ' N ' ' O ' ' A' ' 20' ' ' GLY . 2.9 m -47.99 -52.26 20.51 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.383 -0.823 . . . . 0.0 109.468 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.802 ' CE1' HG21 ' A' ' 27' ' ' THR . 9.4 t-80 -78.77 -31.65 46.22 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 177.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 1.124 HD13 HD12 ' A' ' 19' ' ' LEU . 19.1 mm -71.7 1.73 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.284 -0.885 . . . . 0.0 110.525 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 t -110.64 -67.02 1.02 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.835 -1.165 . . . . 0.0 110.031 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -26.43 68.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.614 -0.679 . . . . 0.0 110.555 -178.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.802 HG21 ' CE1' ' A' ' 23' ' ' HIS . 7.5 m -90.89 -37.33 13.63 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.35 -0.844 . . . . 0.0 111.424 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.753 ' HE1' HG22 ' A' ' 24' ' ' ILE . 48.9 ttp -91.5 -80.12 0.36 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.138 -0.976 . . . . 0.0 109.972 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.472 ' O ' HG23 ' A' ' 30' ' ' ILE . 57.7 t30 -137.25 -61.35 0.65 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.017 -1.052 . . . . 0.0 113.079 -177.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.668 HD13 ' HB ' ' A' ' 34' ' ' THR . 1.4 pp -155.0 -177.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.987 -1.07 . . . . 0.0 112.279 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -34.92 142.14 0.05 Allowed 'General case' 0 N--CA 1.505 2.295 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.34 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.584 ' CB ' ' HB1' ' A' ' 21' ' ' ALA . 1.6 ptt180 -65.76 -22.2 66.57 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.92 -0.487 . . . . 0.0 111.895 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.1 t -64.22 -50.63 67.26 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.668 ' HB ' HD13 ' A' ' 30' ' ' ILE . 81.9 m -63.92 -38.93 92.9 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.487 1.137 . . . . 0.0 107.975 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.934 HG12 HD11 ' A' ' 39' ' ' ILE . 39.7 t -61.69 -26.35 39.47 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.446 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 39' ' ' ILE . 6.5 m-85 -78.59 -23.99 45.68 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.569 -0.707 . . . . 0.0 110.395 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -38.27 83.54 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 11' ' ' VAL . 2.2 t -76.5 -53.61 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.421 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.934 HD11 HG12 ' A' ' 35' ' ' VAL . 14.8 mt -53.35 -30.76 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.425 -0.797 . . . . 0.0 110.183 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -75.5 -42.49 52.71 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -61.49 -23.28 65.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.846 -0.534 . . . . 0.0 110.009 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 73.06 -82.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.572 -0.705 . . . . 0.0 109.692 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.7 p30 . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 117.892 -1.052 . . . . 0.0 109.498 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -91.17 -41.33 11.06 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.566 -0.961 . . . . 0.0 109.423 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.3 mmmt -75.51 150.8 38.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.581 -0.7 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.53 31.55 3.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.585 -0.697 . . . . 0.0 109.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.667 ' HE2' HD11 ' A' ' 6' ' ' ILE . 20.4 tttt -102.43 -67.55 0.87 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.559 -0.713 . . . . 0.0 109.501 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.667 HD11 ' HE2' ' A' ' 5' ' ' LYS . 41.4 mm -93.42 89.81 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.575 -0.703 . . . . 0.0 109.469 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -105.78 137.1 44.22 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.591 -0.693 . . . . 0.0 109.581 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.0 31.59 0.3 Allowed 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -82.06 -20.13 38.88 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.583 -0.698 . . . . 0.0 110.226 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.41 67.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.0 109.805 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.48 -53.35 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.538 -0.726 . . . . 0.0 109.611 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD13 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -55.23 -40.33 70.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.603 -0.686 . . . . 0.0 110.742 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -76.86 -40.87 46.15 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.663 -0.648 . . . . 0.0 111.991 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.743 ' C ' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -85.1 10.11 13.0 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.071 -1.018 . . . . 0.0 111.632 -178.177 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.868 ' NE1' HD11 ' A' ' 39' ' ' ILE . 6.4 m95 -121.52 -53.1 2.01 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.842 -1.161 . . . . 0.0 109.9 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.576 ' HG3' HD13 ' A' ' 12' ' ' LEU . 11.5 mm100 -76.79 -16.84 59.34 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.157 -175.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -74.21 -27.22 60.69 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.205 -0.934 . . . . 0.0 109.104 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.583 ' O ' HD13 ' A' ' 19' ' ' LEU . . . 128.49 66.93 0.12 Allowed Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.743 HD23 ' C ' ' A' ' 14' ' ' MET . 2.6 mm? -126.02 -173.43 2.85 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.46 -1.023 . . . . 0.0 110.645 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -170.24 112.79 0.48 Allowed Glycine 0 N--CA 1.49 2.26 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.611 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 27.32 -83.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.8 m -60.61 -56.57 19.78 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.3 -0.875 . . . . 0.0 110.791 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' HD12 ' A' ' 19' ' ' LEU . 43.9 t-80 -58.02 -30.51 66.17 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.655 HG23 ' O ' ' A' ' 14' ' ' MET . 0.3 OUTLIER -67.97 -36.36 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.772 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.8 t -59.66 -29.94 68.41 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.475 -0.765 . . . . 0.0 109.285 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.36 -52.07 50.7 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.595 -0.691 . . . . 0.0 109.142 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.417 HG21 ' HG3' ' A' ' 14' ' ' MET . 54.6 m -74.23 -72.3 0.29 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.504 ' HE2' ' HB2' ' A' ' 14' ' ' MET . 1.9 ttm -80.93 99.01 8.15 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.7 t30 -57.57 88.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.958 -0.464 . . . . 0.0 111.076 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.708 HD13 HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -160.51 160.97 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 O-C-N 121.463 -0.773 . . . . 0.0 110.04 178.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.59 151.53 47.16 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.574 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 5.1 ptt-85 -75.44 -43.36 50.11 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.358 -0.839 . . . . 0.0 111.459 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -63.82 -43.17 97.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 109.183 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.3 m -57.73 -43.37 85.26 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.711 1.243 . . . . 0.0 108.323 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.708 HG21 HD13 ' A' ' 30' ' ' ILE . 3.2 t -58.93 -37.43 67.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.481 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 4.1 m-85 -71.02 -22.33 62.16 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.478 -0.889 . . . . 0.0 111.43 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mppp? -59.12 -36.36 75.05 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 175.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -71.74 -55.52 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.419 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.868 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.4 mm -53.36 -31.84 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.255 0 CA-C-O 121.842 0.83 . . . . 0.0 110.622 -176.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -71.83 -41.93 67.59 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -91.38 16.67 9.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.709 -0.619 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.0 m -166.13 76.85 0.23 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 109.427 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.437 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -59.29 114.4 2.63 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.504 -0.998 . . . . 0.0 109.991 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -59.82 -170.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.526 -0.734 . . . . 0.0 109.977 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -104.32 144.96 30.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.555 -0.716 . . . . 0.0 109.462 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -60.2 166.67 2.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.527 -0.733 . . . . 0.0 109.995 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -96.84 97.59 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.595 -0.691 . . . . 0.0 109.317 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -104.42 53.32 0.74 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.567 -0.708 . . . . 0.0 109.474 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.614 ' O ' HD13 ' A' ' 12' ' ' LEU . 9.8 mmt180 61.05 68.23 0.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.344 -0.848 . . . . 0.0 109.459 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -69.23 -23.22 63.85 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.524 -0.735 . . . . 0.0 109.828 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.44 -61.7 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.461 -0.775 . . . . 0.0 109.695 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 38' ' ' VAL . 26.5 t -57.99 -34.17 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.468 -0.77 . . . . 0.0 109.762 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 8' ' ' ARG . 5.7 mp -67.03 -35.52 80.06 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -65.09 -27.82 69.03 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.601 ' HB3' HG23 ' A' ' 24' ' ' ILE . 45.1 mtt -69.36 -65.87 0.66 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.472 -0.767 . . . . 0.0 110.38 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 88.7 m95 -68.88 -16.09 63.67 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.442 -0.786 . . . . 0.0 112.861 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -93.08 -0.93 56.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 112.275 -177.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -111.03 22.24 15.51 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.998 -1.064 . . . . 0.0 110.751 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.726 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 74.01 55.5 5.77 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.726 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.6 mp -123.61 -168.68 1.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.546 -0.973 . . . . 0.0 109.261 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.508 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -177.94 116.47 0.54 Allowed Glycine 0 N--CA 1.497 2.756 0 C-N-CA 119.701 -1.238 . . . . 0.0 112.175 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.436 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 30.6 -79.33 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.976 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -45.62 -54.6 7.46 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.485 -0.759 . . . . 0.0 109.435 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.536 ' CE1' ' HB ' ' A' ' 27' ' ' THR . 21.2 t-80 -76.64 -32.64 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.623 HD11 ' HB2' ' A' ' 19' ' ' LEU . 16.9 mm -70.67 0.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 121.428 -0.795 . . . . 0.0 110.676 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.408 ' CB ' ' N ' ' A' ' 32' ' ' ARG . 51.9 p -138.19 -0.27 2.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.976 -1.077 . . . . 0.0 111.958 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -117.3 -39.7 3.16 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 120.891 -1.131 . . . . 0.0 108.312 -179.231 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.536 ' HB ' ' CE1' ' A' ' 23' ' ' HIS . 59.9 m -90.53 -27.43 19.18 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.607 -0.683 . . . . 0.0 109.182 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.443 ' HG3' ' CG ' ' A' ' 14' ' ' MET . 4.0 mmm -81.38 -125.79 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.435 ' H ' HD13 ' A' ' 30' ' ' ILE . 4.1 m120 -143.26 26.67 1.63 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 121.265 1.848 . . . . 0.0 113.364 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -156.49 -177.16 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.676 -1.265 . . . . 0.0 110.952 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.962 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -87.71 152.57 22.04 Favored 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.408 ' N ' ' CB ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -63.85 -39.9 95.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.188 -0.945 . . . . 0.0 112.178 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.6 t -61.7 -44.37 97.07 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.187 -0.946 . . . . 0.0 109.084 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.7 m -62.69 -35.65 80.4 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 122.121 0.962 . . . . 0.0 108.583 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.976 HG12 HD11 ' A' ' 39' ' ' ILE . 43.9 t -63.99 -30.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.717 ' HA ' HD12 ' A' ' 39' ' ' ILE . 7.1 m-85 -75.99 -20.35 57.93 Favored 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 119.81 -0.756 . . . . 0.0 110.413 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -63.18 -37.37 86.97 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 11' ' ' VAL . 2.3 t -77.82 -54.13 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.605 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.976 HD11 HG12 ' A' ' 35' ' ' VAL . 6.8 mt -55.03 -33.02 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.306 -0.871 . . . . 0.0 109.838 -177.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.45 -39.71 62.37 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -97.94 23.65 7.82 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.906 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.4 m -149.88 88.35 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.45 -0.781 . . . . 0.0 109.49 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.7 p30 . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 117.931 -1.033 . . . . 0.0 109.512 179.953 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -64.29 -71.47 0.18 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.531 -0.981 . . . . 0.0 109.485 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -112.15 146.98 37.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.647 -0.658 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -22.55 52.35 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 110.358 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -86.49 155.0 20.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.4 -0.813 . . . . 0.0 109.428 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.6 HD12 ' O ' ' A' ' 6' ' ' ILE . 1.8 pp -144.22 111.61 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.601 -0.687 . . . . 0.0 109.595 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -113.08 96.34 5.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.542 -0.724 . . . . 0.0 109.449 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 61.51 63.29 1.2 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.528 -0.732 . . . . 0.0 109.492 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.68 -30.86 71.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 109.325 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.9 -53.18 58.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.582 -0.699 . . . . 0.0 109.303 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 38' ' ' VAL . 32.4 t -61.01 -30.9 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.555 -0.716 . . . . 0.0 109.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 6.7 tp -58.98 -35.69 73.63 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.703 -0.623 . . . . 0.0 109.64 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -85.82 -16.6 38.2 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.521 -0.737 . . . . 0.0 110.465 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.656 ' HE2' HG13 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -67.3 -48.71 66.82 Favored 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.363 -0.836 . . . . 0.0 110.846 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.566 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 92.6 m95 -102.41 -30.86 10.77 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.557 -1.339 . . . . 0.0 112.315 -178.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.41 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.6 mm-40 -71.34 -22.43 61.91 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -177.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' CD1' ' A' ' 19' ' ' LEU . 94.0 mt-30 -80.27 -32.37 38.23 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.332 -0.855 . . . . 0.0 109.098 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.77 63.97 0.43 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.918 ' HB2' HG23 ' A' ' 24' ' ' ILE . 2.5 mp -122.47 -178.94 4.04 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.41 -1.053 . . . . 0.0 109.98 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.462 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -152.09 118.62 0.91 Allowed Glycine 0 N--CA 1.496 2.691 0 C-N-CA 119.974 -1.107 . . . . 0.0 111.515 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.678 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 32.99 -86.02 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t -67.1 -52.13 45.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.263 -0.898 . . . . 0.0 110.577 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.651 ' ND1' HD23 ' A' ' 19' ' ' LEU . 51.3 t-80 -58.87 -38.92 79.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.534 -0.729 . . . . 0.0 110.04 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.918 HG23 ' HB2' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -57.29 -35.3 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.582 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 30' ' ' ILE . 23.1 t -68.53 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.114 0.483 . . . . 0.0 109.848 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -27.61 65.1 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.55 ' OG1' HD21 ' A' ' 19' ' ' LEU . 46.1 m -90.43 -67.22 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.466 -0.771 . . . . 0.0 111.162 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -92.82 23.87 3.93 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.209 -0.932 . . . . 0.0 111.597 -178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 36.48 84.37 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 177.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.925 HD13 HG21 ' A' ' 35' ' ' VAL . 0.8 OUTLIER -160.25 145.7 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.366 -0.833 . . . . 0.0 109.585 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.636 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -60.3 149.31 33.88 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.208 -0.933 . . . . 0.0 109.102 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.584 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 35.0 ptt180 -74.26 -41.15 61.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.244 -0.91 . . . . 0.0 111.948 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.45 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -67.14 -44.1 80.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 108.544 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.9 m -59.4 -40.08 85.45 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.8 1.286 . . . . 0.0 107.992 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.925 HG21 HD13 ' A' ' 30' ' ' ILE . 5.8 t -60.09 -37.26 72.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.648 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.7 m-85 -67.64 -23.27 65.32 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.997 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -62.96 -35.35 79.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 11' ' ' VAL . 58.7 t -69.87 -60.57 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.664 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 ' O ' ' A' ' 35' ' ' VAL . 2.1 mp -54.99 -31.56 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 CA-C-O 121.718 0.77 . . . . 0.0 109.939 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -67.07 -42.64 84.35 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -100.67 25.22 8.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.731 -0.605 . . . . 0.0 109.701 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.2 t -80.26 -37.64 32.49 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.471 -0.768 . . . . 0.0 109.577 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 117.98 -1.009 . . . . 0.0 109.63 -179.969 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -98.9 38.52 1.37 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.99 . . . . 0.0 109.486 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -98.21 149.61 22.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.588 -0.695 . . . . 0.0 109.523 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.16 51.14 0.93 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.553 -0.717 . . . . 0.0 109.382 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.66 30.5 3.26 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.557 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 6' ' ' ILE . 1.9 pp -149.87 114.42 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.504 -0.747 . . . . 0.0 109.471 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.637 ' OD1' ' HB2' ' A' ' 10' ' ' ALA . 1.8 t0 -113.6 50.34 0.92 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.587 -0.696 . . . . 0.0 109.52 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -61.97 -29.9 70.56 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.447 -0.783 . . . . 0.0 109.748 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -70.23 -29.11 65.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.536 -0.727 . . . . 0.0 109.811 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.637 ' HB2' ' OD1' ' A' ' 7' ' ' ASP . . . -59.02 -46.57 87.88 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.418 -0.801 . . . . 0.0 109.833 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.552 HG12 ' HD1' ' A' ' 15' ' ' TRP . 38.3 t -62.48 -48.53 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 109.052 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.56 -15.9 59.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.72 -0.612 . . . . 0.0 110.503 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -77.46 -43.52 32.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.924 -1.11 . . . . 0.0 110.409 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.949 ' CB ' HG23 ' A' ' 24' ' ' ILE . 27.0 mmt -77.99 -48.75 15.51 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.341 -0.85 . . . . 0.0 111.093 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.843 ' NE1' HD11 ' A' ' 39' ' ' ILE . 83.5 m95 -63.69 -47.4 81.31 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.821 -1.175 . . . . 0.0 111.491 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -67.81 -36.55 80.61 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.88 -0.513 . . . . 0.0 110.854 -177.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -63.05 -24.0 67.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.278 -0.889 . . . . 0.0 109.944 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.47 62.45 0.57 Allowed Glycine 0 N--CA 1.496 2.662 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.915 HD23 ' CD2' ' A' ' 23' ' ' HIS . 2.1 mp -130.72 -172.98 2.95 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.648 -0.913 . . . . 0.0 110.063 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -140.93 129.4 4.08 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.793 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . -15.27 -44.86 0.0 OUTLIER 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 124.837 1.255 . . . . 0.0 114.021 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.3 m -48.84 -74.03 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.282 -0.886 . . . . 0.0 109.81 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.915 ' CD2' HD23 ' A' ' 19' ' ' LEU . 1.3 p-80 -85.98 2.64 45.47 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 121.271 -0.893 . . . . 0.0 111.332 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.949 HG23 ' CB ' ' A' ' 14' ' ' MET . 20.6 mt -75.3 -37.29 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 177.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.404 ' HA ' HG13 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -91.6 -26.95 18.46 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.7 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -42.44 82.83 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.371 -0.831 . . . . 0.0 109.007 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.3 m -79.39 -45.34 19.7 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.57 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.33 110.46 22.22 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.179 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 12.3 m120 -37.96 89.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.829 HD12 HG22 ' A' ' 35' ' ' VAL . 1.1 pt -179.46 176.2 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -98.8 162.66 12.98 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.307 -0.87 . . . . 0.0 109.13 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.793 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 28.4 ptt180 -77.5 -38.3 49.29 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.2 -0.937 . . . . 0.0 110.607 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.437 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -73.7 -39.45 64.34 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.1 m -61.07 -39.69 90.86 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.596 1.189 . . . . 0.0 107.829 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.829 HG22 HD12 ' A' ' 30' ' ' ILE . 14.0 t -61.01 -41.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 5.1 m-85 -68.4 -19.76 64.63 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.845 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -59.76 -37.37 78.84 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.38 -56.65 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.325 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.843 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.5 mm -52.21 -31.47 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 CA-C-O 121.796 0.808 . . . . 0.0 110.581 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -74.07 -41.82 61.13 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -96.7 23.51 6.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.795 -0.566 . . . . 0.0 109.851 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -85.94 -31.36 22.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.435 -0.791 . . . . 0.0 109.451 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.501 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.52 -163.98 0.9 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.586 -0.95 . . . . 0.0 109.325 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -94.1 46.47 1.17 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.555 -0.716 . . . . 0.0 109.419 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 30.7 mtt180 -107.87 156.84 18.72 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.46 -0.775 . . . . 0.0 109.494 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.81 121.57 45.53 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.611 -0.68 . . . . 0.0 109.492 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.7 mm -121.97 84.02 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.554 -0.717 . . . . 0.0 109.453 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.12 171.31 7.42 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.56 -0.713 . . . . 0.0 109.463 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 73.29 -80.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.8 -0.563 . . . . 0.0 110.256 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.92 -23.8 61.7 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.955 -1.091 . . . . 0.0 110.154 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -47.5 76.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.8 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.767 HG11 ' CG1' ' A' ' 38' ' ' VAL . 74.7 t -64.52 -57.89 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.2 tt -53.4 -23.23 9.2 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.827 -0.546 . . . . 0.0 110.952 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -72.59 -40.01 66.92 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.395 -0.816 . . . . 0.0 110.396 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.823 ' CB ' HG23 ' A' ' 24' ' ' ILE . 11.4 mmt -67.72 -45.43 75.05 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.433 -0.792 . . . . 0.0 111.682 -178.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.917 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 62.9 m95 -70.61 -27.57 64.18 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.121 -0.987 . . . . 0.0 110.577 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -81.83 -18.66 43.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.483 -0.761 . . . . 0.0 110.432 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.537 ' HB2' HD22 ' A' ' 19' ' ' LEU . 4.2 mm100 -85.09 -31.43 23.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.0 109.681 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.24 -0.61 7.05 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.625 HD23 ' HA ' ' A' ' 14' ' ' MET . 0.4 OUTLIER -62.42 -176.48 0.11 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.111 -1.229 . . . . 0.0 109.906 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -155.24 121.5 1.11 Allowed Glycine 0 N--CA 1.494 2.526 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.262 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.822 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 20.57 -80.46 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 178.193 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.412 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.3 t -44.45 -59.91 2.2 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.535 -0.728 . . . . 0.0 111.089 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.489 ' CD2' ' HG ' ' A' ' 19' ' ' LEU . 5.9 t60 -67.38 -40.07 85.69 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.451 -0.781 . . . . 0.0 109.251 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.823 HG23 ' CB ' ' A' ' 14' ' ' MET . 62.8 mt -69.12 -7.91 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.517 -0.739 . . . . 0.0 111.045 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.411 ' HB3' ' N ' ' A' ' 31' ' ' ALA . 10.1 m -113.92 -71.78 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.477 -0.764 . . . . 0.0 111.266 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -38.72 73.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.851 -1.155 . . . . 0.0 110.29 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.618 HG22 ' CE ' ' A' ' 28' ' ' MET . 13.0 m -93.16 -27.17 17.06 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.963 -0.695 . . . . 0.0 111.969 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.618 ' CE ' HG22 ' A' ' 27' ' ' THR . 13.8 mmt -118.08 -42.71 2.79 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.058 -1.026 . . . . 0.0 112.049 -177.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.6 m-80 -119.52 -93.5 0.52 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.887 -1.133 . . . . 0.0 111.473 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.771 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 175.2 114.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 O-C-N 121.135 -0.978 . . . . 0.0 109.438 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.411 ' N ' ' HB3' ' A' ' 25' ' ' SER . . . 61.58 143.63 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.395 -0.816 . . . . 0.0 110.042 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.822 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -82.61 -45.85 14.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.067 -1.021 . . . . 0.0 111.873 -178.441 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.423 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 59.4 p -62.41 -42.42 99.43 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.126 -0.983 . . . . 0.0 108.526 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.2 m -63.43 -49.68 72.79 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 39' ' ' ILE . 2.7 t -56.92 -22.08 15.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.368 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.872 ' CD1' HD12 ' A' ' 39' ' ' ILE . 1.1 m-85 -75.79 -36.33 59.81 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.897 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -55.39 -36.34 66.29 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.767 ' CG1' HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -64.38 -50.23 77.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.824 179.236 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.917 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 5.0 mt -57.4 -38.36 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-O 121.537 0.684 . . . . 0.0 109.946 -177.058 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.49 -39.15 92.55 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -63.35 -29.55 70.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.823 -0.548 . . . . 0.0 109.642 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.1 m -118.37 27.46 8.94 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.563 -0.711 . . . . 0.0 109.797 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 117.985 -1.007 . . . . 0.0 109.815 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -92.34 127.36 37.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.639 -0.918 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -120.76 80.13 1.59 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.589 -0.695 . . . . 0.0 109.398 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.83 92.08 2.49 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.59 -0.694 . . . . 0.0 109.392 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 156.81 17.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.568 -0.707 . . . . 0.0 109.551 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.638 HG22 ' H ' ' A' ' 7' ' ' ASP . 7.5 mt 59.89 175.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.576 -0.702 . . . . 0.0 109.137 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.751 ' O ' HG23 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -125.27 46.78 2.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.416 -0.803 . . . . 0.0 109.62 -179.609 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -70.42 -77.62 0.08 Allowed 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.569 -0.707 . . . . 0.0 109.676 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -63.43 -24.8 67.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.496 -0.752 . . . . 0.0 109.86 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.592 ' HB3' ' OD1' ' A' ' 7' ' ' ASP . . . -62.41 -44.82 95.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.43 -0.793 . . . . 0.0 109.827 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 38' ' ' VAL . 87.0 t -62.8 -50.27 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.341 -0.849 . . . . 0.0 108.998 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.431 HD23 ' O ' ' A' ' 12' ' ' LEU . 3.6 tt -56.36 -29.42 61.37 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.896 -0.502 . . . . 0.0 110.678 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -70.34 -33.83 71.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.455 -0.778 . . . . 0.0 110.098 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.641 ' HB3' HG22 ' A' ' 24' ' ' ILE . 30.7 mmt -65.3 -47.98 74.71 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.561 -0.712 . . . . 0.0 110.007 -179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 1.007 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 78.9 m95 -62.42 -33.2 74.32 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.11 -0.994 . . . . 0.0 110.177 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -63.35 -22.19 66.73 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.684 -0.635 . . . . 0.0 110.742 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.61 22.54 4.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.357 -0.839 . . . . 0.0 110.35 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.06 54.85 10.27 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.809 ' HB3' HG23 ' A' ' 24' ' ' ILE . 4.8 mp -110.01 162.97 14.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.551 -0.97 . . . . 0.0 110.455 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.488 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -154.35 119.17 0.91 Allowed Glycine 0 N--CA 1.499 2.87 0 C-N-CA 120.031 -1.08 . . . . 0.0 111.721 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.669 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 31.39 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.465 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.0 m -66.1 -53.69 34.92 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.315 -0.866 . . . . 0.0 110.696 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -58.28 -32.78 68.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.587 -0.696 . . . . 0.0 110.169 -179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.809 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -67.03 -36.73 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.892 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 179.038 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 t -59.81 -28.46 67.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.505 -0.747 . . . . 0.0 109.429 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.59 -51.84 60.67 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.6 m -75.12 -71.39 0.36 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.619 ' SD ' HD11 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -78.14 96.18 5.11 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 177.681 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.535 ' C ' HD13 ' A' ' 30' ' ' ILE . 5.4 m-20 -59.92 83.83 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.619 HD11 ' SD ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -156.34 174.44 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.251 -0.905 . . . . 0.0 109.484 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -74.71 141.66 44.47 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.451 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 3.2 ppt_? -70.56 -38.76 74.18 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.076 -178.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 p -64.49 -40.78 96.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.995 -1.065 . . . . 0.0 108.814 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.2 m -64.17 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 31' ' ' ALA . 71.3 t -59.88 -29.99 44.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.882 ' CD1' HD12 ' A' ' 39' ' ' ILE . 2.9 m-85 -72.12 -31.42 66.01 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.976 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -36.79 68.42 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.383 1.087 . . . . 0.0 108.206 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -68.6 -55.49 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.073 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 1.007 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 1.1 mt -54.65 -45.01 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 121.93 0.871 . . . . 0.0 109.478 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -60.56 -39.1 86.72 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -64.13 -28.9 70.09 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.274 -0.571 . . . . 0.0 109.626 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 t -69.96 -45.92 66.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.539 -0.725 . . . . 0.0 109.502 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.467 -179.963 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -79.43 85.77 5.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.59 -0.947 . . . . 0.0 109.424 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -102.81 40.54 1.36 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.541 -0.725 . . . . 0.0 109.534 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -96.75 40.83 1.12 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.565 -0.709 . . . . 0.0 109.346 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -87.75 -31.1 19.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.571 -0.706 . . . . 0.0 109.422 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.486 HG22 ' N ' ' A' ' 7' ' ' ASP . 44.0 mm -68.95 162.7 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.568 -0.707 . . . . 0.0 109.238 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.486 ' N ' HG22 ' A' ' 6' ' ' ILE . 12.3 t70 -93.3 47.87 1.28 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.525 -0.734 . . . . 0.0 109.571 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 -87.11 -59.69 2.19 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.582 -0.699 . . . . 0.0 109.485 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -64.01 -24.56 67.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.611 -0.681 . . . . 0.0 109.92 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.95 -52.11 65.37 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.359 -0.838 . . . . 0.0 109.71 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 38' ' ' VAL . 22.2 t -60.61 -34.83 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.6 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.842 HD23 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -61.2 -39.06 88.8 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.783 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -66.98 -26.31 66.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.419 -0.801 . . . . 0.0 109.981 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.872 ' SD ' HD11 ' A' ' 30' ' ' ILE . 3.2 mtm -67.4 -67.08 0.48 Allowed 'General case' 0 C--N 1.306 -1.288 0 O-C-N 121.345 -0.847 . . . . 0.0 111.146 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.586 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 90.0 m95 -66.23 -40.03 89.99 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.087 -1.008 . . . . 0.0 112.081 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.842 ' HG3' HD23 ' A' ' 12' ' ' LEU . 14.8 mm100 -59.29 -20.83 57.58 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.662 -0.649 . . . . 0.0 110.815 -177.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -89.47 -27.33 20.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.324 -0.86 . . . . 0.0 109.75 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.72 68.84 0.55 Allowed Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.231 -1.548 . . . . 0.0 109.231 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.906 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -120.9 162.61 19.55 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.626 -0.926 . . . . 0.0 109.995 -178.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.5 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -136.22 118.92 1.9 Allowed Glycine 0 N--CA 1.5 2.937 0 C-N-CA 120.264 -0.969 . . . . 0.0 111.586 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.715 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 31.22 -85.36 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 179.031 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 t -67.68 -53.11 30.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.3 -0.875 . . . . 0.0 110.55 -178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 -59.06 -26.49 64.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.595 -0.691 . . . . 0.0 110.551 -179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.906 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.92 -36.44 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.889 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 179.402 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -64.41 -40.9 96.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.718 -0.614 . . . . 0.0 110.105 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -60.72 -34.4 74.35 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.475 -0.765 . . . . 0.0 109.926 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.4 m -71.25 -58.49 3.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.517 -0.739 . . . . 0.0 109.947 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.42 ' HB2' ' CE ' ' A' ' 14' ' ' MET . 23.9 mmt -104.61 -140.83 0.36 Allowed 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.718 ' O ' HG23 ' A' ' 30' ' ' ILE . 1.4 t-20 -137.48 88.21 2.32 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.332 -1.48 . . . . 0.0 111.82 -178.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.891 HD13 HG22 ' A' ' 35' ' ' VAL . 1.1 pp -168.29 153.49 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 O-C-N 121.234 -0.916 . . . . 0.0 110.39 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.821 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -71.69 167.04 20.69 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.715 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 7.1 ppt_? -64.26 -41.47 96.94 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.236 -0.915 . . . . 0.0 111.529 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.04 -30.22 58.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.163 -0.96 . . . . 0.0 108.953 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.3 m -63.93 -34.66 78.47 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.891 HG22 HD13 ' A' ' 30' ' ' ILE . 2.5 t -63.58 -45.03 98.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' HA ' HD12 ' A' ' 39' ' ' ILE . 14.4 m-85 -62.94 -16.71 60.27 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 120.156 -0.618 . . . . 0.0 111.498 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.4 -39.1 85.56 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 175.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 11' ' ' VAL . 66.3 t -71.49 -60.91 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.034 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.803 HD11 HG12 ' A' ' 35' ' ' VAL . 1.8 mp -55.67 -32.98 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 CA-C-O 121.758 0.79 . . . . 0.0 109.63 -176.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -65.54 -41.68 92.8 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.19 -34.08 76.86 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.714 -0.616 . . . . 0.0 109.476 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m 59.64 37.18 22.55 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.54 -0.725 . . . . 0.0 109.793 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.2 t30 . . . . . 0 N--CA 1.496 1.851 0 CA-C-O 117.997 -1.001 . . . . 0.0 109.711 179.988 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -65.23 157.55 28.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.575 -0.956 . . . . 0.0 109.41 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -102.21 88.91 3.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.626 -0.672 . . . . 0.0 109.566 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -65.18 -34.88 79.44 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.569 -0.707 . . . . 0.0 109.358 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -75.78 -169.68 1.13 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.626 -0.671 . . . . 0.0 109.326 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mm 61.24 105.8 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.484 -0.76 . . . . 0.0 109.551 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.41 -171.68 2.54 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.621 -0.674 . . . . 0.0 109.524 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 12' ' ' LEU . 31.2 mmt180 59.87 19.43 8.36 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.604 -0.685 . . . . 0.0 110.232 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.42 -33.93 73.71 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.284 -0.885 . . . . 0.0 109.674 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.11 72.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.558 -0.714 . . . . 0.0 109.773 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.61 HG12 ' HD1' ' A' ' 15' ' ' TRP . 10.6 t -76.94 -32.34 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 8' ' ' ARG . 0.9 OUTLIER -63.04 -22.74 67.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.469 -0.77 . . . . 0.0 109.427 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -83.5 -45.83 13.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.102 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.701 ' O ' HG23 ' A' ' 24' ' ' ILE . 24.0 ptp -71.03 -3.82 21.68 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.508 -0.745 . . . . 0.0 111.486 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.61 ' HD1' HG12 ' A' ' 11' ' ' VAL . 33.5 m95 -120.57 -42.46 2.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.463 -1.398 . . . . 0.0 111.22 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -78.7 0.67 25.75 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.382 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -103.77 22.71 13.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.097 -1.002 . . . . 0.0 110.041 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.504 ' O ' HD12 ' A' ' 19' ' ' LEU . . . 76.59 63.55 2.32 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.504 HD12 ' O ' ' A' ' 18' ' ' GLY . 0.8 OUTLIER -127.41 160.3 31.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.742 -0.858 . . . . 0.0 110.452 -178.679 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.439 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.5 125.23 1.41 Allowed Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.01 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.5 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 30.1 -84.41 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.1 t -63.92 -52.03 61.7 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.267 -0.896 . . . . 0.0 111.161 -177.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.429 ' HA ' ' NZ ' ' A' ' 26' ' ' LYS . 58.5 t-80 -61.49 -30.72 70.79 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.446 -0.783 . . . . 0.0 109.834 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.701 HG23 ' O ' ' A' ' 14' ' ' MET . 0.2 OUTLIER -77.26 -24.36 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.942 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.778 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.9 t -58.52 -48.32 81.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.966 -1.083 . . . . 0.0 110.319 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.429 ' NZ ' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -73.9 -36.72 64.78 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.531 -179.239 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.0 m -62.12 -69.56 0.24 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.35 -0.843 . . . . 0.0 109.759 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.439 ' HE1' HG22 ' A' ' 35' ' ' VAL . 1.5 ptt? -80.07 -134.73 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.467 ' O ' HG23 ' A' ' 30' ' ' ILE . 36.2 m-20 -157.69 45.31 0.35 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.368 -1.458 . . . . 0.0 113.1 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.467 HG23 ' O ' ' A' ' 29' ' ' ASN . 14.3 pt -154.25 166.6 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.958 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.426 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -57.21 162.48 2.64 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 110.404 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -72.55 -33.88 67.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.757 -0.589 . . . . 0.0 111.645 -178.825 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.476 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 12.3 p -74.78 -35.54 62.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.022 -1.048 . . . . 0.0 108.775 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 73.7 m -61.26 -33.22 73.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.473 ' C ' HD12 ' A' ' 39' ' ' ILE . 0.5 OUTLIER -65.86 -40.89 88.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.844 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 39' ' ' ILE . 12.3 m-85 -67.03 -13.77 62.24 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 119.421 -0.911 . . . . 0.0 110.981 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -69.05 -40.23 78.67 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.16 -1.792 . . . . 0.0 106.16 174.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.48 HG11 HG21 ' A' ' 11' ' ' VAL . 2.3 t -77.87 -56.06 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.282 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 36' ' ' TYR . 4.2 mt -54.17 -34.12 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.407 -0.808 . . . . 0.0 109.316 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.33 -40.96 73.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -60.98 -30.29 70.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.703 -0.623 . . . . 0.0 109.795 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t 62.18 -86.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.93 -0.482 . . . . 0.0 109.827 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.496 1.831 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.773 -179.938 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -69.21 103.79 2.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.575 -0.956 . . . . 0.0 109.488 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.96 113.92 4.77 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.672 -0.643 . . . . 0.0 109.479 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -57.17 10.39 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.553 -0.717 . . . . 0.0 109.471 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 158.68 24.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.605 -0.685 . . . . 0.0 109.407 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.638 HD12 ' O ' ' A' ' 6' ' ' ILE . 2.4 pp -141.99 125.45 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.606 -0.684 . . . . 0.0 109.457 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -110.73 168.81 9.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.561 -0.712 . . . . 0.0 109.504 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.726 ' NH2' HD12 ' A' ' 12' ' ' LEU . 7.9 ptt180 41.48 49.29 3.53 Favored 'General case' 0 N--CA 1.507 2.394 0 CA-C-O 121.229 0.537 . . . . 0.0 111.772 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.69 -28.67 61.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.336 -0.852 . . . . 0.0 109.564 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.06 -54.84 5.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.546 -0.721 . . . . 0.0 110.029 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 38' ' ' VAL . 19.0 t -58.78 -40.19 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 109.176 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.726 HD12 ' NH2' ' A' ' 8' ' ' ARG . 5.5 tt -59.2 -39.07 81.48 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -57.44 -33.85 68.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.446 -0.784 . . . . 0.0 109.079 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.902 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.3 mmt -62.59 -45.92 90.65 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.827 -0.546 . . . . 0.0 109.655 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.979 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 32.8 m95 -79.54 -0.27 32.73 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.171 -0.955 . . . . 0.0 111.079 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.58 ' HG3' HD23 ' A' ' 12' ' ' LEU . 7.9 mm100 -100.33 -21.5 15.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.962 -1.086 . . . . 0.0 111.321 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.431 ' HB2' HD11 ' A' ' 19' ' ' LEU . 94.4 mm-40 -95.62 10.61 36.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.133 -0.98 . . . . 0.0 111.362 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.564 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 84.24 65.58 1.52 Allowed Glycine 0 N--CA 1.496 2.642 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.851 HD13 ' O ' ' A' ' 14' ' ' MET . 7.4 mp -124.18 -172.59 2.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.668 -0.901 . . . . 0.0 109.309 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -164.62 120.87 0.97 Allowed Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.002 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.562 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 17.38 -72.45 0.0 OUTLIER 'General case' 0 N--CA 1.522 3.163 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 20' ' ' GLY . 41.6 m -50.61 -59.98 3.5 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.118 -0.989 . . . . 0.0 110.361 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.621 ' O ' HG22 ' A' ' 27' ' ' THR . 17.4 t-80 -65.65 -38.42 89.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.392 -0.818 . . . . 0.0 109.341 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.902 HG23 ' HB3' ' A' ' 14' ' ' MET . 38.6 mt -72.96 -7.23 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.609 -0.682 . . . . 0.0 110.36 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.454 ' OG ' HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -87.21 -68.62 0.74 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.545 -0.722 . . . . 0.0 110.054 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.758 ' HA ' HG22 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -55.5 -26.17 41.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.623 -0.673 . . . . 0.0 110.685 -179.353 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.621 HG22 ' O ' ' A' ' 23' ' ' HIS . 12.8 t -85.67 -36.57 20.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.495 -0.753 . . . . 0.0 109.942 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.733 ' HG2' HG22 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -141.17 112.89 7.66 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -178.549 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.781 ' O ' HG22 ' A' ' 35' ' ' VAL . 4.3 t-20 40.35 90.08 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.707 -0.621 . . . . 0.0 111.862 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.758 HG22 ' HA ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -58.02 -162.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.679 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.971 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 63.38 105.47 0.03 OUTLIER 'General case' 0 C--O 1.193 -1.876 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.436 ' CD ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 mtm180 -57.62 -52.83 63.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.686 -0.634 . . . . 0.0 111.66 -176.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -57.78 -40.98 81.11 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.112 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 88.3 m -67.57 -31.75 72.03 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.952 0.882 . . . . 0.0 108.938 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.971 HG23 ' O ' ' A' ' 31' ' ' ALA . 89.1 t -66.69 -31.19 52.4 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.89 ' CD1' HD12 ' A' ' 39' ' ' ILE . 16.2 m-85 -76.25 -23.02 54.46 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.368 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -37.85 84.12 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 11' ' ' VAL . 1.3 t -67.94 -52.72 36.35 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.344 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.979 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 4.5 mt -58.43 -36.65 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-O 121.819 0.819 . . . . 0.0 110.052 -176.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -66.05 -36.98 84.71 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -57.15 -21.31 31.8 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.723 -0.611 . . . . 0.0 110.117 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.4 t -57.05 -53.28 59.85 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.349 -0.845 . . . . 0.0 109.949 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.8 p30 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.488 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -95.78 108.03 20.32 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.618 -0.931 . . . . 0.0 109.517 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -71.35 162.36 29.56 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.607 -0.683 . . . . 0.0 109.454 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -90.54 -172.28 3.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.581 -0.7 . . . . 0.0 109.525 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -101.88 169.84 8.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.557 -0.714 . . . . 0.0 109.544 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 6' ' ' ILE . 2.6 pp -143.14 133.78 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.581 -0.7 . . . . 0.0 109.496 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -103.81 103.12 12.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.609 -0.682 . . . . 0.0 109.512 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -62.13 -37.28 84.55 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.602 -0.686 . . . . 0.0 109.85 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.06 -26.3 66.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.519 -0.738 . . . . 0.0 110.163 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.739 ' HB1' ' SD ' ' A' ' 28' ' ' MET . . . -62.79 -53.07 59.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.467 -0.771 . . . . 0.0 109.915 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.899 HG11 ' CG1' ' A' ' 38' ' ' VAL . 45.4 t -59.43 -34.6 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.287 -0.883 . . . . 0.0 109.387 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 16.1 mt -65.27 -33.48 76.07 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -66.56 -31.02 71.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.164 -0.96 . . . . 0.0 110.562 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.948 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.4 mtm -70.51 -61.04 1.92 Allowed 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.278 -0.889 . . . . 0.0 111.372 -178.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 97.7 m95 -76.33 -42.01 46.49 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.295 -0.878 . . . . 0.0 112.963 -176.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 7.9 mm100 -63.25 -26.42 68.77 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.599 -0.688 . . . . 0.0 110.489 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -78.38 -24.41 46.37 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.311 -0.868 . . . . 0.0 109.807 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.12 63.13 0.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.831 HD12 ' O ' ' A' ' 14' ' ' MET . 8.4 mt -119.51 -173.63 2.56 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.932 . . . . 0.0 110.831 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -145.45 116.51 0.91 Allowed Glycine 0 N--CA 1.498 2.832 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.469 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.705 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 10.1 -65.35 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.3 1.592 . . . . 0.0 115.3 178.413 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.5 m -45.61 -57.44 4.18 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.07 -1.019 . . . . 0.0 110.826 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.863 ' CE1' HG21 ' A' ' 27' ' ' THR . 13.8 t-80 -81.52 -31.0 33.0 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.392 -0.818 . . . . 0.0 109.365 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.948 HG23 ' HB3' ' A' ' 14' ' ' MET . 67.8 mt -61.82 -21.99 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.298 -0.876 . . . . 0.0 110.613 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 p -109.05 -54.45 2.53 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.307 -0.871 . . . . 0.0 110.596 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -24.86 65.1 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.434 -0.791 . . . . 0.0 110.235 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.863 HG21 ' CE1' ' A' ' 23' ' ' HIS . 18.4 m -86.4 -57.01 3.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.453 -0.779 . . . . 0.0 109.828 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.739 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -65.66 -101.97 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.572 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 30' ' ' ILE . 25.7 t-20 -163.58 64.66 0.17 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.551 -1.343 . . . . 0.0 111.039 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.764 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.7 OUTLIER -176.43 -175.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 O-C-N 121.084 -1.01 . . . . 0.0 110.075 179.471 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.936 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -97.83 170.64 8.83 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.55 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -64.4 -46.67 82.26 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 0.0 111.703 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 1.0 OUTLIER -67.88 -36.25 79.92 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.206 -0.934 . . . . 0.0 108.753 -179.605 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.6 m -61.06 -35.23 76.39 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.938 HG12 HD11 ' A' ' 39' ' ' ILE . 12.2 t -64.17 -34.22 67.46 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.309 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 39' ' ' ILE . 13.4 m-85 -75.28 -15.36 60.52 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.397 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.28 -39.42 86.01 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.899 ' CG1' HG11 ' A' ' 11' ' ' VAL . 2.1 t -74.47 -55.01 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.237 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.938 HD11 HG12 ' A' ' 35' ' ' VAL . 6.3 mt -56.03 -33.28 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.407 -0.808 . . . . 0.0 109.631 -177.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.17 -40.6 82.27 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -63.48 -28.1 69.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.79 -0.569 . . . . 0.0 109.586 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t 61.05 32.62 19.79 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.441 -0.787 . . . . 0.0 109.584 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.454 -179.992 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -102.53 139.03 38.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.612 -0.934 . . . . 0.0 109.512 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.71 30.68 3.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.638 -0.664 . . . . 0.0 109.474 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -88.63 82.08 6.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.552 -0.718 . . . . 0.0 109.453 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.619 ' O ' HD13 ' A' ' 6' ' ' ILE . 4.4 tttt -102.68 71.28 1.17 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.585 -0.697 . . . . 0.0 109.381 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.619 HD13 ' O ' ' A' ' 5' ' ' LYS . 46.0 mm -132.39 65.63 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.507 -0.746 . . . . 0.0 109.517 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.24 44.92 0.99 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.446 -0.784 . . . . 0.0 109.28 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 173.62 75.64 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.83 -29.14 60.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.515 -0.74 . . . . 0.0 109.703 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.15 -59.05 3.52 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.579 -0.701 . . . . 0.0 109.678 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.424 HG11 HG11 ' A' ' 38' ' ' VAL . 46.0 t -60.87 -38.4 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.564 -0.71 . . . . 0.0 109.626 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 12' ' ' LEU . 31.9 mt -70.98 -21.72 62.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 110.359 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -71.74 -47.4 54.03 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.999 -1.063 . . . . 0.0 110.709 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.746 ' SD ' HD13 ' A' ' 30' ' ' ILE . 12.7 ptp -73.32 -48.21 36.26 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.295 -0.878 . . . . 0.0 112.339 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.752 ' NE1' HD11 ' A' ' 39' ' ' ILE . 75.3 m95 -65.57 -49.83 67.36 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.653 -1.279 . . . . 0.0 111.686 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 mm-40 -62.81 -25.8 68.43 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.901 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -71.33 -29.57 65.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.315 -0.866 . . . . 0.0 109.114 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.26 50.84 0.21 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HG23 ' A' ' 24' ' ' ILE . 1.7 mp -112.07 168.96 9.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.589 -0.948 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.479 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -153.67 117.76 0.82 Allowed Glycine 0 N--CA 1.498 2.805 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.851 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 34.94 -86.6 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -70.96 -51.65 24.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.174 -0.954 . . . . 0.0 110.236 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -57.39 -30.49 64.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.607 -0.683 . . . . 0.0 110.142 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.768 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -65.43 -39.7 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.752 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.53 -32.42 68.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.703 -0.623 . . . . 0.0 109.84 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -43.78 98.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.573 -0.704 . . . . 0.0 109.162 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.765 ' OG1' HD21 ' A' ' 19' ' ' LEU . 6.4 m -74.1 -66.58 0.7 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.547 -0.72 . . . . 0.0 109.414 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' ILE . 3.4 mtm -117.14 109.97 17.59 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -45.35 102.53 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.706 -0.621 . . . . 0.0 112.063 -178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 1.046 HD12 HG21 ' A' ' 35' ' ' VAL . 35.7 pt -143.79 159.4 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.64 -0.663 . . . . 0.0 109.9 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.749 ' HB3' ' HB ' ' A' ' 34' ' ' THR . . . -85.51 150.75 24.46 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.661 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 33.5 ptt180 -77.57 -46.48 22.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.914 -1.116 . . . . 0.0 111.893 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 47.2 p -71.49 -39.1 71.06 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.18 -0.95 . . . . 0.0 108.577 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.749 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 85.9 m -59.78 -46.84 87.95 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.465 1.126 . . . . 0.0 108.804 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 1.046 HG21 HD12 ' A' ' 30' ' ' ILE . 27.3 t -60.08 -38.68 77.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.454 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.8 m-85 -69.01 -18.94 64.11 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.24 -178.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -61.28 -37.58 83.7 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 174.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.579 HG13 ' O ' ' A' ' 43' ' ' ASN . 2.2 t -77.05 -49.13 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.818 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.752 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.6 mm -57.37 -37.61 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.884 -1.135 . . . . 0.0 110.086 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -68.82 -40.25 79.59 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.18 -14.41 62.26 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.838 -0.539 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.426 ' O ' ' ND2' ' A' ' 43' ' ' ASN . 7.8 t 61.15 30.37 19.32 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.144 -0.973 . . . . 0.0 109.568 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.579 ' O ' HG13 ' A' ' 38' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.003 -0.998 . . . . 0.0 109.32 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.7 ptt180 -59.08 -27.32 65.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.452 -1.028 . . . . 0.0 110.077 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 116.25 3.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.526 -0.734 . . . . 0.0 110.008 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.12 -59.77 1.55 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.595 -0.691 . . . . 0.0 109.405 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -87.97 -172.03 3.66 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.595 -0.69 . . . . 0.0 109.464 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 46.3 mm -66.92 121.36 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.567 -0.708 . . . . 0.0 109.392 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -64.62 -170.34 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.698 . . . . 0.0 109.125 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -96.37 27.45 3.76 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.484 -0.76 . . . . 0.0 109.99 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.431 ' HA ' HD12 ' A' ' 12' ' ' LEU . 21.5 t70 -70.33 -23.95 62.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.413 -0.804 . . . . 0.0 109.88 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.75 -54.31 37.33 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 109.768 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.607 ' CB ' HG11 ' A' ' 38' ' ' VAL . 56.7 t -58.07 -39.91 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.471 -0.768 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 9' ' ' ASP . 95.6 mt -59.7 -37.75 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.68 -0.637 . . . . 0.0 109.777 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -65.87 -28.13 68.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.59 -0.693 . . . . 0.0 109.968 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.786 ' O ' HD22 ' A' ' 19' ' ' LEU . 25.4 mmt -63.97 -52.86 57.69 Favored 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.388 -0.82 . . . . 0.0 109.766 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.677 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 86.5 m95 -63.93 -31.81 73.12 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.257 -0.902 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -67.58 -18.87 65.15 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.804 -0.56 . . . . 0.0 110.713 -178.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -95.91 14.12 24.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.263 -0.898 . . . . 0.0 110.663 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.28 63.06 2.45 Favored Glycine 0 N--CA 1.495 2.611 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -118.43 153.98 33.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.697 -0.884 . . . . 0.0 110.293 -179.224 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -141.32 121.8 1.95 Allowed Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.349 -0.929 . . . . 0.0 110.961 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.656 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.18 -84.78 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.3 m -64.12 -54.14 38.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.334 -0.854 . . . . 0.0 111.097 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -60.15 -32.79 71.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.801 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -64.36 -32.68 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.076 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -69.93 -27.71 64.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.661 -0.65 . . . . 0.0 109.496 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -47.61 83.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.283 -0.886 . . . . 0.0 109.031 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -74.16 -64.1 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.577 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -98.98 98.06 9.15 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.017 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -52.15 89.26 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.664 -0.647 . . . . 0.0 112.334 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.47 HD12 ' O ' ' A' ' 28' ' ' MET . 0.1 OUTLIER -151.39 161.99 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.172 -0.955 . . . . 0.0 109.111 177.89 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.556 ' HB3' ' OG1' ' A' ' 34' ' ' THR . . . -72.41 158.83 35.02 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.341 -0.849 . . . . 0.0 109.429 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -67.84 -42.33 81.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.55 -0.719 . . . . 0.0 111.213 -179.06 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.426 ' N ' ' HD2' ' A' ' 32' ' ' ARG . 3.3 p -72.46 -32.84 66.58 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.064 -1.022 . . . . 0.0 108.37 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.556 ' OG1' ' HB3' ' A' ' 31' ' ' ALA . 89.6 m -62.23 -30.28 70.98 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.562 ' O ' HD12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -68.23 -40.54 82.88 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.664 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.646 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.716 ' HA ' HD12 ' A' ' 39' ' ' ILE . 20.3 m-85 -67.1 -11.98 58.7 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.762 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -74.58 -39.06 62.48 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.607 HG11 ' CB ' ' A' ' 11' ' ' VAL . 2.4 t -78.7 -54.38 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.147 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.716 HD12 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mt -55.69 -38.13 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.906 -177.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -66.04 -40.84 91.33 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -61.76 -28.89 69.77 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.708 -0.62 . . . . 0.0 109.754 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -96.86 85.94 3.91 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.5 -0.75 . . . . 0.0 109.528 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 118.028 -0.986 . . . . 0.0 109.728 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -70.38 -24.6 62.98 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.948 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -67.19 0.42 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.426 -0.796 . . . . 0.0 109.997 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.633 HG21 HG11 ' A' ' 38' ' ' VAL . 20.7 t -65.45 -32.39 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.5 -0.75 . . . . 0.0 109.643 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.488 ' O ' HD23 ' A' ' 12' ' ' LEU . 8.7 tt -61.03 -22.49 64.61 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.588 -0.695 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -92.86 -44.05 8.68 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.825 ' O ' HD13 ' A' ' 19' ' ' LEU . 1.7 mpp? -61.69 -14.1 28.61 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.462 -0.774 . . . . 0.0 111.615 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.864 ' NE1' HD11 ' A' ' 39' ' ' ILE . 69.0 m95 -113.0 -42.72 3.51 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.725 -1.235 . . . . 0.0 110.869 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -75.64 -3.96 37.48 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.527 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -95.36 -29.3 14.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.089 -1.007 . . . . 0.0 109.519 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.94 75.94 0.42 Allowed Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.825 HD13 ' O ' ' A' ' 14' ' ' MET . 4.9 mp -133.25 -173.43 3.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.483 -1.01 . . . . 0.0 110.031 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.61 116.97 0.74 Allowed Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.03 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.651 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.01 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 22.0 t -61.76 -56.4 19.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 110.667 -178.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -57.92 -27.6 63.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.482 -0.761 . . . . 0.0 110.533 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.706 HG22 ' HE2' ' A' ' 28' ' ' MET . 0.3 OUTLIER -72.45 -39.01 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.806 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.65 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 99.1 p -65.2 -46.32 81.22 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.695 -0.628 . . . . 0.0 110.052 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -28.14 67.21 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.743 . . . . 0.0 109.829 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 m -79.32 -38.46 35.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.528 -0.732 . . . . 0.0 110.361 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.706 ' HE2' HG22 ' A' ' 24' ' ' ILE . 2.6 ptt? -110.27 -153.22 0.51 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.441 ' O ' HG23 ' A' ' 30' ' ' ILE . 8.4 p-10 -120.4 46.75 1.91 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.263 -0.898 . . . . 0.0 112.315 -177.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.684 ' CD1' HG22 ' A' ' 35' ' ' VAL . 15.4 pt -153.91 148.58 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 120.801 -1.187 . . . . 0.0 110.636 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.695 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -62.73 174.28 1.08 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.653 -0.654 . . . . 0.0 109.836 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.594 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -75.61 -41.48 54.33 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 111.662 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.411 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 4.9 t -68.93 -37.42 78.89 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.4 m -64.06 -37.3 86.93 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 31' ' ' ALA . 14.4 t -60.37 -41.2 86.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.7 m-85 -70.25 -18.42 63.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.973 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -59.98 -36.63 77.55 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 174.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 HG21 ' A' ' 11' ' ' VAL . 17.4 t -72.82 -57.44 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.449 178.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.864 HD11 ' NE1' ' A' ' 15' ' ' TRP . 6.0 mm -52.98 -31.35 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.837 0.827 . . . . 0.0 110.61 -176.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -74.34 -41.0 61.79 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -60.65 -33.31 72.63 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.709 -0.619 . . . . 0.0 109.796 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.497 1.884 0 O-C-N 121.49 -0.756 . . . . 0.0 109.725 179.949 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? . . . . . 0 N--CA 1.483 1.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -22.67 65.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.559 -0.713 . . . . 0.0 109.976 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.94 -50.86 30.03 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.408 -0.807 . . . . 0.0 109.769 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.554 ' CG1' HG13 ' A' ' 35' ' ' VAL . 46.8 t -60.65 -44.65 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.504 -0.747 . . . . 0.0 109.429 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.555 HD13 ' OG ' ' A' ' 42' ' ' SER . 6.8 tp -63.55 -30.97 72.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.779 -0.576 . . . . 0.0 109.786 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -66.26 -30.71 71.2 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.377 -0.827 . . . . 0.0 110.142 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.511 ' O ' HD22 ' A' ' 19' ' ' LEU . 6.6 mmt -70.89 -56.48 6.18 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 121.429 -0.794 . . . . 0.0 110.285 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CE2' HG21 ' A' ' 24' ' ' ILE . 98.3 m95 -58.86 -40.03 83.12 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.318 -0.864 . . . . 0.0 111.494 -178.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -67.95 -16.31 64.0 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.823 -0.548 . . . . 0.0 111.891 -176.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.424 ' HB2' HD13 ' A' ' 19' ' ' LEU . 72.0 mt-30 -94.82 22.04 6.86 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.161 -0.962 . . . . 0.0 110.773 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.728 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 72.95 54.08 7.42 Favored Glycine 0 N--CA 1.5 2.939 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.728 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.5 mp -122.91 -170.8 2.17 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.924 . . . . 0.0 108.938 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.548 ' N ' HG12 ' A' ' 24' ' ' ILE . . . 178.39 116.13 0.48 Allowed Glycine 0 N--CA 1.499 2.864 0 C-N-CA 119.376 -1.392 . . . . 0.0 112.899 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.458 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 32.55 -78.98 0.0 OUTLIER 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 20' ' ' GLY . 29.6 t -44.16 -42.51 6.45 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.61 ' CD2' HD23 ' A' ' 19' ' ' LEU . 7.2 t60 -94.57 -29.47 14.87 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 177.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.743 HG21 ' CE2' ' A' ' 15' ' ' TRP . 16.6 mm -76.19 8.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 121.217 -0.927 . . . . 0.0 110.762 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.7 m -137.4 -35.13 0.68 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.052 -1.03 . . . . 0.0 111.05 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.36 -36.22 16.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.833 -1.167 . . . . 0.0 110.305 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 32.2 m -91.39 -28.84 17.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.42 -0.8 . . . . 0.0 111.301 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.459 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -101.01 34.18 2.59 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.232 -0.917 . . . . 0.0 109.402 -178.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.518 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.9 p-10 33.95 58.64 0.59 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 177.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.799 HD12 ' CG2' ' A' ' 35' ' ' VAL . 6.0 pt -157.79 172.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.524 -0.735 . . . . 0.0 109.054 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -96.69 156.4 16.36 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.41 ' HG3' ' N ' ' A' ' 33' ' ' SER . 8.2 ptp180 -78.0 -45.93 22.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.848 -1.158 . . . . 0.0 111.53 -178.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -63.99 -42.25 97.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.11 -0.994 . . . . 0.0 108.943 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.2 m -63.68 -44.84 92.55 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 122.574 1.178 . . . . 0.0 108.236 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.926 HG12 HD11 ' A' ' 39' ' ' ILE . 12.0 t -63.4 -21.5 28.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' ILE . 2.1 m-85 -79.08 -24.54 43.43 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.21 -0.931 . . . . 0.0 110.137 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 mtpt -61.96 -37.45 84.8 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.86 -54.28 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.997 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.926 HD11 HG12 ' A' ' 35' ' ' VAL . 12.2 mt -53.99 -30.74 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 O-C-N 121.449 -0.782 . . . . 0.0 110.077 -178.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -72.69 -41.19 65.56 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.97 22.58 7.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.773 -0.579 . . . . 0.0 109.863 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.555 ' OG ' HD13 ' A' ' 12' ' ' LEU . 25.6 t . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 109.423 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.13 -23.33 62.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.626 -0.671 . . . . 0.0 109.972 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.798 ' HB1' ' HE1' ' A' ' 28' ' ' MET . . . -62.34 -55.74 25.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.388 -0.82 . . . . 0.0 109.731 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.607 HG22 ' SD ' ' A' ' 28' ' ' MET . 40.8 t -66.89 -42.1 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.493 -0.755 . . . . 0.0 109.285 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -26.45 61.85 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.567 -0.708 . . . . 0.0 109.946 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -86.8 -32.64 20.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.367 -0.833 . . . . 0.0 109.357 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.646 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -82.64 5.11 22.19 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.623 -0.673 . . . . 0.0 111.141 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.595 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 10.1 m95 -128.24 -49.47 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.386 1.089 . . . . 0.0 109.691 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.06 -15.25 61.51 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.008 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -80.16 -27.68 38.94 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.191 -0.943 . . . . 0.0 109.48 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.77 65.85 0.26 Allowed Glycine 0 N--CA 1.496 2.64 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.852 HD23 ' CD2' ' A' ' 23' ' ' HIS . 4.9 mp -127.98 -171.74 2.52 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.497 -1.002 . . . . 0.0 110.158 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.439 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -154.55 112.21 0.52 Allowed Glycine 0 N--CA 1.496 2.677 0 C-N-CA 119.647 -1.263 . . . . 0.0 111.777 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 16.25 -74.31 0.0 OUTLIER 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.4 p -48.65 -59.35 3.59 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.179 -0.951 . . . . 0.0 110.776 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.852 ' CD2' HD23 ' A' ' 19' ' ' LEU . 6.1 t60 -64.93 -37.51 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.775 HD12 ' N ' ' A' ' 21' ' ' ALA . 78.8 mt -66.73 -14.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.813 -0.554 . . . . 0.0 110.283 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 p -81.18 -40.79 23.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 108.789 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' N ' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -66.18 -55.33 16.84 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.453 HG23 ' N ' ' A' ' 28' ' ' MET . 4.1 t -62.64 -48.24 80.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.638 -0.664 . . . . 0.0 109.461 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.798 ' HE1' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -107.44 93.57 4.62 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 178.506 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.735 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.0 t-20 -47.94 96.36 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.06 HD12 HG22 ' A' ' 35' ' ' VAL . 1.2 pt -172.01 147.95 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.955 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -61.27 155.92 19.92 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.808 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -64.31 -35.2 80.08 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.185 -0.947 . . . . 0.0 111.244 -178.361 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 86.9 p -75.42 -36.73 60.73 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.144 -0.973 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.7 m -61.8 -34.96 76.85 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 1.06 HG22 HD12 ' A' ' 30' ' ' ILE . 8.9 t -66.08 -34.79 72.61 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.39 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 39' ' ' ILE . 16.1 m-85 -75.25 -13.3 60.43 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.85 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -68.98 -38.4 79.3 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 174.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.4 HG11 HG11 ' A' ' 11' ' ' VAL . 2.1 t -76.7 -54.38 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.094 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.908 HD11 HG12 ' A' ' 35' ' ' VAL . 5.6 mt -56.07 -34.26 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.414 -0.804 . . . . 0.0 109.563 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -69.79 -40.71 75.85 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -59.94 -28.75 67.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.923 -0.485 . . . . 0.0 109.773 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.53 -0.731 . . . . 0.0 109.346 179.909 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 121.034 0.445 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -62.27 -31.05 71.57 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.521 -0.737 . . . . 0.0 109.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.53 -42.04 98.45 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.585 -0.697 . . . . 0.0 109.881 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 38' ' ' VAL . 45.8 t -62.6 -49.28 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.529 -0.732 . . . . 0.0 109.076 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.65 -8.71 57.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.733 -0.604 . . . . 0.0 110.486 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -38.03 48.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.866 -1.147 . . . . 0.0 109.748 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.542 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.9 mmt -83.66 -45.26 13.64 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.495 -0.753 . . . . 0.0 110.45 -179.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CH2' HD11 ' A' ' 24' ' ' ILE . 35.0 m95 -55.14 -51.24 67.08 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.924 -1.11 . . . . 0.0 110.14 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -63.68 -28.27 69.79 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.472 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -73.89 -29.31 62.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.281 -0.887 . . . . 0.0 109.318 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.94 65.32 0.23 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.803 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -133.47 160.56 37.05 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.446 -1.032 . . . . 0.0 109.963 -179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.48 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -138.59 121.91 2.26 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.484 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 28.45 -83.4 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.5 t -64.43 -56.35 14.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.411 -0.806 . . . . 0.0 111.235 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.675 ' CD2' HD23 ' A' ' 19' ' ' LEU . 82.1 t60 -57.04 -30.03 63.9 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.369 -0.832 . . . . 0.0 110.21 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.803 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.49 -34.61 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.7 p -62.78 -34.58 77.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.634 -0.666 . . . . 0.0 109.331 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -34.83 78.8 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.41 ' O ' ' HE3' ' A' ' 28' ' ' MET . 2.2 m -88.89 -76.42 0.4 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.823 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.436 ' HE2' ' HA ' ' A' ' 28' ' ' MET . 19.1 mmt -155.79 82.78 1.02 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.282 -0.886 . . . . 0.0 110.032 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.85 ' OD1' HG11 ' A' ' 35' ' ' VAL . 1.6 t-20 -152.74 -41.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.726 -1.234 . . . . 0.0 112.756 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER 50.75 145.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.915 0 CA-C-O 121.834 0.826 . . . . 0.0 112.359 -177.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.715 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 40.03 97.27 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.684 -0.635 . . . . 0.0 111.248 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.653 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -68.61 -42.53 77.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.969 -1.082 . . . . 0.0 112.535 -177.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 70.8 m -63.72 -43.9 95.18 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.045 -1.035 . . . . 0.0 108.845 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -63.1 -36.22 82.86 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.176 0.988 . . . . 0.0 108.617 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.895 HG12 HD11 ' A' ' 39' ' ' ILE . 38.0 t -65.2 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.736 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.6 m-85 -75.48 -21.0 58.43 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -64.18 -36.23 83.39 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 175.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 11' ' ' VAL . 3.2 t -74.41 -56.12 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.162 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.895 HD11 HG12 ' A' ' 35' ' ' VAL . 5.7 mt -55.53 -32.49 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.356 -0.84 . . . . 0.0 109.828 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -69.75 -40.4 76.15 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -62.73 -30.26 71.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.769 -0.582 . . . . 0.0 109.569 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.626 -0.671 . . . . 0.0 109.437 179.994 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.041 0.448 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.17 -33.96 75.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.586 -0.696 . . . . 0.0 109.424 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.86 70.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.595 -0.69 . . . . 0.0 109.425 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 38' ' ' VAL . 47.0 t -65.35 -50.69 71.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.01 -23.81 67.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.669 -0.644 . . . . 0.0 109.718 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -63.28 -45.32 91.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.169 -0.957 . . . . 0.0 109.698 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 9.6 mmt -64.27 -43.11 95.84 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.463 -0.773 . . . . 0.0 110.025 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.651 ' CE2' HG21 ' A' ' 24' ' ' ILE . 80.0 m95 -67.78 -25.02 65.4 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.003 -1.061 . . . . 0.0 112.184 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -97.1 13.12 30.27 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.535 -0.728 . . . . 0.0 112.476 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.488 ' HB2' HD21 ' A' ' 19' ' ' LEU . 20.6 mm-40 -105.85 -22.25 12.97 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.073 -1.017 . . . . 0.0 110.562 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.44 -49.68 0.81 Allowed Glycine 0 N--CA 1.498 2.785 0 N-CA-C 108.42 -1.872 . . . . 0.0 108.42 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 1.124 HD12 HD13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -48.47 173.78 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 122.015 -0.697 . . . . 0.0 110.979 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.511 ' HA2' HG13 ' A' ' 24' ' ' ILE . . . -167.45 135.64 3.75 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.954 -1.117 . . . . 0.0 111.503 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.584 ' HB1' ' CB ' ' A' ' 32' ' ' ARG . . . 36.68 -83.41 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.442 ' N ' ' O ' ' A' ' 20' ' ' GLY . 2.9 m -47.99 -52.26 20.51 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.383 -0.823 . . . . 0.0 109.468 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.881 ' CD2' HD13 ' A' ' 19' ' ' LEU . 4.9 t60 -78.77 -31.65 46.22 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 177.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 1.124 HD13 HD12 ' A' ' 19' ' ' LEU . 19.1 mm -71.7 1.73 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.284 -0.885 . . . . 0.0 110.525 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 t -110.64 -67.02 1.02 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.835 -1.165 . . . . 0.0 110.031 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -26.43 68.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.614 -0.679 . . . . 0.0 110.555 -178.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.602 HG21 ' NE2' ' A' ' 23' ' ' HIS . 7.5 m -90.89 -37.33 13.63 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.35 -0.844 . . . . 0.0 111.424 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.753 ' HE1' HG22 ' A' ' 24' ' ' ILE . 48.9 ttp -91.5 -80.12 0.36 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.138 -0.976 . . . . 0.0 109.972 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.472 ' O ' HG23 ' A' ' 30' ' ' ILE . 57.7 t30 -137.25 -61.35 0.65 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.017 -1.052 . . . . 0.0 113.079 -177.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.668 HD13 ' HB ' ' A' ' 34' ' ' THR . 1.4 pp -155.0 -177.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.987 -1.07 . . . . 0.0 112.279 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -34.92 142.14 0.05 Allowed 'General case' 0 N--CA 1.505 2.295 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.34 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.584 ' CB ' ' HB1' ' A' ' 21' ' ' ALA . 1.6 ptt180 -65.76 -22.2 66.57 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.92 -0.487 . . . . 0.0 111.895 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.1 t -64.22 -50.63 67.26 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.668 ' HB ' HD13 ' A' ' 30' ' ' ILE . 81.9 m -63.92 -38.93 92.9 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.487 1.137 . . . . 0.0 107.975 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.934 HG12 HD11 ' A' ' 39' ' ' ILE . 39.7 t -61.69 -26.35 39.47 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.446 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 39' ' ' ILE . 6.5 m-85 -78.59 -23.99 45.68 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.569 -0.707 . . . . 0.0 110.395 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -38.27 83.54 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 11' ' ' VAL . 2.2 t -76.5 -53.61 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.421 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.934 HD11 HG12 ' A' ' 35' ' ' VAL . 14.8 mt -53.35 -30.76 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.425 -0.797 . . . . 0.0 110.183 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.5 -42.49 52.71 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -61.49 -23.28 65.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.846 -0.534 . . . . 0.0 110.009 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.072 0 O-C-N 121.572 -0.705 . . . . 0.0 109.692 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -82.06 -20.13 38.88 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.583 -0.698 . . . . 0.0 110.226 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.41 67.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.0 109.805 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.48 -53.35 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.538 -0.726 . . . . 0.0 109.611 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.576 HD13 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -55.23 -40.33 70.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.603 -0.686 . . . . 0.0 110.742 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -76.86 -40.87 46.15 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.663 -0.648 . . . . 0.0 111.991 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.743 ' C ' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -85.1 10.11 13.0 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.071 -1.018 . . . . 0.0 111.632 -178.177 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.868 ' NE1' HD11 ' A' ' 39' ' ' ILE . 6.4 m95 -121.52 -53.1 2.01 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.842 -1.161 . . . . 0.0 109.9 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.576 ' HG3' HD13 ' A' ' 12' ' ' LEU . 18.2 mm-40 -76.79 -16.84 59.34 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.157 -175.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -74.21 -27.22 60.69 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.205 -0.934 . . . . 0.0 109.104 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.583 ' O ' HD13 ' A' ' 19' ' ' LEU . . . 128.49 66.93 0.12 Allowed Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.743 HD23 ' C ' ' A' ' 14' ' ' MET . 2.6 mm? -126.02 -173.43 2.85 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.46 -1.023 . . . . 0.0 110.645 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -170.24 112.79 0.48 Allowed Glycine 0 N--CA 1.49 2.26 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.611 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 27.32 -83.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.8 m -60.61 -56.57 19.78 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.3 -0.875 . . . . 0.0 110.791 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.695 ' CD2' HD12 ' A' ' 19' ' ' LEU . 7.4 t60 -58.02 -30.51 66.17 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.655 HG23 ' O ' ' A' ' 14' ' ' MET . 0.3 OUTLIER -67.97 -36.36 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.772 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.8 t -59.66 -29.94 68.41 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.475 -0.765 . . . . 0.0 109.285 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.36 -52.07 50.7 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.595 -0.691 . . . . 0.0 109.142 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.417 HG21 ' HG3' ' A' ' 14' ' ' MET . 54.6 m -74.23 -72.3 0.29 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.504 ' HE2' ' HB2' ' A' ' 14' ' ' MET . 1.9 ttm -80.93 99.01 8.15 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.7 t30 -57.57 88.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.958 -0.464 . . . . 0.0 111.076 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.708 HD13 HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -160.51 160.97 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 O-C-N 121.463 -0.773 . . . . 0.0 110.04 178.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.59 151.53 47.16 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.574 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 5.1 ptt-85 -75.44 -43.36 50.11 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.358 -0.839 . . . . 0.0 111.459 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -63.82 -43.17 97.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 109.183 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.3 m -57.73 -43.37 85.26 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.711 1.243 . . . . 0.0 108.323 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.708 HG21 HD13 ' A' ' 30' ' ' ILE . 3.2 t -58.93 -37.43 67.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.481 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 4.1 m-85 -71.02 -22.33 62.16 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.478 -0.889 . . . . 0.0 111.43 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mppp? -59.12 -36.36 75.05 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 175.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -71.74 -55.52 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.419 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.868 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.4 mm -53.36 -31.84 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.255 0 CA-C-O 121.842 0.83 . . . . 0.0 110.622 -176.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -71.83 -41.93 67.59 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -91.38 16.67 9.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.709 -0.619 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 109.427 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.614 ' O ' HD13 ' A' ' 12' ' ' LEU . 9.8 mmt180 . . . . . 0 N--CA 1.495 1.784 0 CA-C-O 121.384 0.611 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -69.23 -23.22 63.85 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.524 -0.735 . . . . 0.0 109.828 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.44 -61.7 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.461 -0.775 . . . . 0.0 109.695 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 38' ' ' VAL . 26.5 t -57.99 -34.17 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.468 -0.77 . . . . 0.0 109.762 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 8' ' ' ARG . 5.7 mp -67.03 -35.52 80.06 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -65.09 -27.82 69.03 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.601 ' HB3' HG23 ' A' ' 24' ' ' ILE . 45.1 mtt -69.36 -65.87 0.66 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.472 -0.767 . . . . 0.0 110.38 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 88.7 m95 -68.88 -16.09 63.67 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.442 -0.786 . . . . 0.0 112.861 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -93.08 -0.93 56.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 112.275 -177.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -111.03 22.24 15.51 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.998 -1.064 . . . . 0.0 110.751 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.726 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 74.01 55.5 5.77 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.726 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.6 mp -123.61 -168.68 1.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.546 -0.973 . . . . 0.0 109.261 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.508 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -177.94 116.47 0.54 Allowed Glycine 0 N--CA 1.497 2.756 0 C-N-CA 119.701 -1.238 . . . . 0.0 112.175 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.436 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 30.6 -79.33 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.976 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -45.62 -54.6 7.46 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.485 -0.759 . . . . 0.0 109.435 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.505 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 6.8 t60 -76.64 -32.64 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.623 HD11 ' HB2' ' A' ' 19' ' ' LEU . 16.9 mm -70.67 0.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 121.428 -0.795 . . . . 0.0 110.676 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.408 ' CB ' ' N ' ' A' ' 32' ' ' ARG . 51.9 p -138.19 -0.27 2.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.976 -1.077 . . . . 0.0 111.958 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -117.3 -39.7 3.16 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 120.891 -1.131 . . . . 0.0 108.312 -179.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.404 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 59.9 m -90.53 -27.43 19.18 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.607 -0.683 . . . . 0.0 109.182 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.443 ' HG3' ' CG ' ' A' ' 14' ' ' MET . 4.0 mmm -81.38 -125.79 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.435 ' H ' HD13 ' A' ' 30' ' ' ILE . 4.1 m120 -143.26 26.67 1.63 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 121.265 1.848 . . . . 0.0 113.364 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.661 ' N ' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -156.49 -177.16 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.676 -1.265 . . . . 0.0 110.952 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.962 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -87.71 152.57 22.04 Favored 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.408 ' N ' ' CB ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -63.85 -39.9 95.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.188 -0.945 . . . . 0.0 112.178 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.6 t -61.7 -44.37 97.07 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.187 -0.946 . . . . 0.0 109.084 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.7 m -62.69 -35.65 80.4 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 122.121 0.962 . . . . 0.0 108.583 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.976 HG12 HD11 ' A' ' 39' ' ' ILE . 43.9 t -63.99 -30.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.717 ' HA ' HD12 ' A' ' 39' ' ' ILE . 7.1 m-85 -75.99 -20.35 57.93 Favored 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 119.81 -0.756 . . . . 0.0 110.413 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -63.18 -37.37 86.97 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 11' ' ' VAL . 2.3 t -77.82 -54.13 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.605 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.976 HD11 HG12 ' A' ' 35' ' ' VAL . 6.8 mt -55.03 -33.02 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.306 -0.871 . . . . 0.0 109.838 -177.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.45 -39.71 62.37 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -97.94 23.65 7.82 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.906 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.4 m . . . . . 0 N--CA 1.493 1.682 0 O-C-N 121.45 -0.781 . . . . 0.0 109.49 179.984 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.793 0 CA-C-O 121.35 0.595 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.68 -30.86 71.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 109.325 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.9 -53.18 58.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.582 -0.699 . . . . 0.0 109.303 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 38' ' ' VAL . 32.4 t -61.01 -30.9 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.555 -0.716 . . . . 0.0 109.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 6.7 tp -58.98 -35.69 73.63 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.703 -0.623 . . . . 0.0 109.64 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -85.82 -16.6 38.2 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.521 -0.737 . . . . 0.0 110.465 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.656 ' HE2' HG13 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -67.3 -48.71 66.82 Favored 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.363 -0.836 . . . . 0.0 110.846 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.566 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 92.6 m95 -102.41 -30.86 10.77 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.557 -1.339 . . . . 0.0 112.315 -178.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.41 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.6 mm-40 -71.34 -22.43 61.91 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -177.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' CD1' ' A' ' 19' ' ' LEU . 94.0 mt-30 -80.27 -32.37 38.23 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.332 -0.855 . . . . 0.0 109.098 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.77 63.97 0.43 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.918 ' HB2' HG23 ' A' ' 24' ' ' ILE . 2.5 mp -122.47 -178.94 4.04 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.41 -1.053 . . . . 0.0 109.98 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.462 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -152.09 118.62 0.91 Allowed Glycine 0 N--CA 1.496 2.691 0 C-N-CA 119.974 -1.107 . . . . 0.0 111.515 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.678 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 32.99 -86.02 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t -67.1 -52.13 45.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.263 -0.898 . . . . 0.0 110.577 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.846 ' CD2' HD23 ' A' ' 19' ' ' LEU . 82.8 t60 -58.87 -38.92 79.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.534 -0.729 . . . . 0.0 110.04 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.918 HG23 ' HB2' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -57.29 -35.3 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.582 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 30' ' ' ILE . 23.1 t -68.53 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.114 0.483 . . . . 0.0 109.848 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -27.61 65.1 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.55 ' OG1' HD21 ' A' ' 19' ' ' LEU . 46.1 m -90.43 -67.22 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.466 -0.771 . . . . 0.0 111.162 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -92.82 23.87 3.93 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.209 -0.932 . . . . 0.0 111.597 -178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 36.48 84.37 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 177.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.925 HD13 HG21 ' A' ' 35' ' ' VAL . 0.8 OUTLIER -160.25 145.7 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.366 -0.833 . . . . 0.0 109.585 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.636 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -60.3 149.31 33.88 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.208 -0.933 . . . . 0.0 109.102 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.584 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 35.0 ptt180 -74.26 -41.15 61.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.244 -0.91 . . . . 0.0 111.948 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.45 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -67.14 -44.1 80.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 108.544 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.9 m -59.4 -40.08 85.45 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.8 1.286 . . . . 0.0 107.992 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.925 HG21 HD13 ' A' ' 30' ' ' ILE . 5.8 t -60.09 -37.26 72.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.648 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.7 m-85 -67.64 -23.27 65.32 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.997 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -62.96 -35.35 79.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 11' ' ' VAL . 58.7 t -69.87 -60.57 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.664 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 ' O ' ' A' ' 35' ' ' VAL . 2.1 mp -54.99 -31.56 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 CA-C-O 121.718 0.77 . . . . 0.0 109.939 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -67.07 -42.64 84.35 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -100.67 25.22 8.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.731 -0.605 . . . . 0.0 109.701 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 N--CA 1.493 1.704 0 O-C-N 121.471 -0.768 . . . . 0.0 109.577 -179.911 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 121.181 0.515 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -70.23 -29.11 65.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.536 -0.727 . . . . 0.0 109.811 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.57 ' HB1' ' SD ' ' A' ' 28' ' ' MET . . . -59.02 -46.57 87.88 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.418 -0.801 . . . . 0.0 109.833 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.552 HG12 ' HD1' ' A' ' 15' ' ' TRP . 38.3 t -62.48 -48.53 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 109.052 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.56 -15.9 59.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.72 -0.612 . . . . 0.0 110.503 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -77.46 -43.52 32.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.924 -1.11 . . . . 0.0 110.409 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.949 ' CB ' HG23 ' A' ' 24' ' ' ILE . 27.0 mmt -77.99 -48.75 15.51 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.341 -0.85 . . . . 0.0 111.093 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.843 ' NE1' HD11 ' A' ' 39' ' ' ILE . 83.5 m95 -63.69 -47.4 81.31 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.821 -1.175 . . . . 0.0 111.491 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -67.81 -36.55 80.61 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.88 -0.513 . . . . 0.0 110.854 -177.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -63.05 -24.0 67.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.278 -0.889 . . . . 0.0 109.944 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.47 62.45 0.57 Allowed Glycine 0 N--CA 1.496 2.662 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.915 HD23 ' CD2' ' A' ' 23' ' ' HIS . 2.1 mp -130.72 -172.98 2.95 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.648 -0.913 . . . . 0.0 110.063 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -140.93 129.4 4.08 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.793 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . -15.27 -44.86 0.0 OUTLIER 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 124.837 1.255 . . . . 0.0 114.021 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.3 m -48.84 -74.03 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.282 -0.886 . . . . 0.0 109.81 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.915 ' CD2' HD23 ' A' ' 19' ' ' LEU . 1.3 p-80 -85.98 2.64 45.47 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 121.271 -0.893 . . . . 0.0 111.332 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.949 HG23 ' CB ' ' A' ' 14' ' ' MET . 20.6 mt -75.3 -37.29 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 177.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.404 ' HA ' HG13 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -91.6 -26.95 18.46 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.7 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -42.44 82.83 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.371 -0.831 . . . . 0.0 109.007 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.3 m -79.39 -45.34 19.7 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.57 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.33 110.46 22.22 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.179 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 12.3 m120 -37.96 89.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.829 HD12 HG22 ' A' ' 35' ' ' VAL . 1.1 pt -179.46 176.2 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -98.8 162.66 12.98 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.307 -0.87 . . . . 0.0 109.13 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.793 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 28.4 ptt180 -77.5 -38.3 49.29 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.2 -0.937 . . . . 0.0 110.607 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.437 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -73.7 -39.45 64.34 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.1 m -61.07 -39.69 90.86 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.596 1.189 . . . . 0.0 107.829 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.829 HG22 HD12 ' A' ' 30' ' ' ILE . 14.0 t -61.01 -41.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 5.1 m-85 -68.4 -19.76 64.63 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.845 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -59.76 -37.37 78.84 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.38 -56.65 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.325 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.843 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.5 mm -52.21 -31.47 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 CA-C-O 121.796 0.808 . . . . 0.0 110.581 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -74.07 -41.82 61.13 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -96.7 23.51 6.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.795 -0.566 . . . . 0.0 109.851 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.435 -0.791 . . . . 0.0 109.451 179.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 . . . . . 0 N--CA 1.502 2.159 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.92 -23.8 61.7 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.955 -1.091 . . . . 0.0 110.154 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -47.5 76.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.8 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.767 HG11 ' CG1' ' A' ' 38' ' ' VAL . 74.7 t -64.52 -57.89 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.2 tt -53.4 -23.23 9.2 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.827 -0.546 . . . . 0.0 110.952 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -72.59 -40.01 66.92 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.395 -0.816 . . . . 0.0 110.396 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.823 ' CB ' HG23 ' A' ' 24' ' ' ILE . 11.4 mmt -67.72 -45.43 75.05 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.433 -0.792 . . . . 0.0 111.682 -178.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.917 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 62.9 m95 -70.61 -27.57 64.18 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.121 -0.987 . . . . 0.0 110.577 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -81.83 -18.66 43.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.483 -0.761 . . . . 0.0 110.432 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.537 ' HB2' HD22 ' A' ' 19' ' ' LEU . 4.2 mm100 -85.09 -31.43 23.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.0 109.681 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.24 -0.61 7.05 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.625 HD23 ' HA ' ' A' ' 14' ' ' MET . 0.4 OUTLIER -62.42 -176.48 0.11 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.111 -1.229 . . . . 0.0 109.906 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -155.24 121.5 1.11 Allowed Glycine 0 N--CA 1.494 2.526 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.262 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.822 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 20.57 -80.46 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 178.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.412 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.3 t -44.45 -59.91 2.2 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.535 -0.728 . . . . 0.0 111.089 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.489 ' CD2' ' HG ' ' A' ' 19' ' ' LEU . 5.9 t60 -67.38 -40.07 85.69 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.451 -0.781 . . . . 0.0 109.251 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.823 HG23 ' CB ' ' A' ' 14' ' ' MET . 62.8 mt -69.12 -7.91 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.517 -0.739 . . . . 0.0 111.045 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.411 ' HB3' ' N ' ' A' ' 31' ' ' ALA . 10.1 m -113.92 -71.78 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.477 -0.764 . . . . 0.0 111.266 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -38.72 73.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.851 -1.155 . . . . 0.0 110.29 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.618 HG22 ' CE ' ' A' ' 28' ' ' MET . 13.0 m -93.16 -27.17 17.06 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.963 -0.695 . . . . 0.0 111.969 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.618 ' CE ' HG22 ' A' ' 27' ' ' THR . 13.8 mmt -118.08 -42.71 2.79 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.058 -1.026 . . . . 0.0 112.049 -177.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.6 m-80 -119.52 -93.5 0.52 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.887 -1.133 . . . . 0.0 111.473 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.771 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 175.2 114.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 O-C-N 121.135 -0.978 . . . . 0.0 109.438 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.411 ' N ' ' HB3' ' A' ' 25' ' ' SER . . . 61.58 143.63 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.395 -0.816 . . . . 0.0 110.042 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.822 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -82.61 -45.85 14.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.067 -1.021 . . . . 0.0 111.873 -178.441 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.423 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 59.4 p -62.41 -42.42 99.43 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.126 -0.983 . . . . 0.0 108.526 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.2 m -63.43 -49.68 72.79 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 39' ' ' ILE . 2.7 t -56.92 -22.08 15.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.368 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.872 ' CD1' HD12 ' A' ' 39' ' ' ILE . 1.1 m-85 -75.79 -36.33 59.81 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.897 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -55.39 -36.34 66.29 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.767 ' CG1' HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -64.38 -50.23 77.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.824 179.236 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.917 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 5.0 mt -57.4 -38.36 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-O 121.537 0.684 . . . . 0.0 109.946 -177.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.49 -39.15 92.55 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -63.35 -29.55 70.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.823 -0.548 . . . . 0.0 109.642 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.1 m . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.563 -0.711 . . . . 0.0 109.797 -179.916 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 121.211 0.529 . . . . 0.0 109.676 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -63.43 -24.8 67.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.496 -0.752 . . . . 0.0 109.86 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -44.82 95.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.43 -0.793 . . . . 0.0 109.827 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 38' ' ' VAL . 87.0 t -62.8 -50.27 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.341 -0.849 . . . . 0.0 108.998 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.431 ' O ' HD23 ' A' ' 12' ' ' LEU . 3.6 tt -56.36 -29.42 61.37 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.896 -0.502 . . . . 0.0 110.678 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -70.34 -33.83 71.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.455 -0.778 . . . . 0.0 110.098 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.641 ' HB3' HG22 ' A' ' 24' ' ' ILE . 30.7 mmt -65.3 -47.98 74.71 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.561 -0.712 . . . . 0.0 110.007 -179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 1.007 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 78.9 m95 -62.42 -33.2 74.32 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.11 -0.994 . . . . 0.0 110.177 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -63.35 -22.19 66.73 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.684 -0.635 . . . . 0.0 110.742 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.61 22.54 4.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.357 -0.839 . . . . 0.0 110.35 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.06 54.85 10.27 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.809 ' HB3' HG23 ' A' ' 24' ' ' ILE . 4.8 mp -110.01 162.97 14.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.551 -0.97 . . . . 0.0 110.455 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.488 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -154.35 119.17 0.91 Allowed Glycine 0 N--CA 1.499 2.87 0 C-N-CA 120.031 -1.08 . . . . 0.0 111.721 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.669 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 31.39 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.465 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.0 m -66.1 -53.69 34.92 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.315 -0.866 . . . . 0.0 110.696 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -58.28 -32.78 68.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.587 -0.696 . . . . 0.0 110.169 -179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.809 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -67.03 -36.73 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.892 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 179.038 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 t -59.81 -28.46 67.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.505 -0.747 . . . . 0.0 109.429 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.59 -51.84 60.67 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.6 m -75.12 -71.39 0.36 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.619 ' SD ' HD11 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -78.14 96.18 5.11 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 177.681 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.535 ' C ' HD13 ' A' ' 30' ' ' ILE . 5.4 m-20 -59.92 83.83 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.619 HD11 ' SD ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -156.34 174.44 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.251 -0.905 . . . . 0.0 109.484 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -74.71 141.66 44.47 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.451 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 3.2 ppt_? -70.56 -38.76 74.18 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.076 -178.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 p -64.49 -40.78 96.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.995 -1.065 . . . . 0.0 108.814 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.2 m -64.17 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 31' ' ' ALA . 71.3 t -59.88 -29.99 44.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.882 ' CD1' HD12 ' A' ' 39' ' ' ILE . 2.9 m-85 -72.12 -31.42 66.01 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.976 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -36.79 68.42 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.383 1.087 . . . . 0.0 108.206 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -68.6 -55.49 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.073 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 1.007 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 1.1 mt -54.65 -45.01 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 121.93 0.871 . . . . 0.0 109.478 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -60.56 -39.1 86.72 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -64.13 -28.9 70.09 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.274 -0.571 . . . . 0.0 109.626 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.539 -0.725 . . . . 0.0 109.502 179.989 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -64.01 -24.56 67.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.611 -0.681 . . . . 0.0 109.92 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.95 -52.11 65.37 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.359 -0.838 . . . . 0.0 109.71 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 38' ' ' VAL . 22.2 t -60.61 -34.83 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.6 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.842 HD23 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -61.2 -39.06 88.8 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.783 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -66.98 -26.31 66.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.419 -0.801 . . . . 0.0 109.981 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.872 ' SD ' HD11 ' A' ' 30' ' ' ILE . 3.2 mtm -67.4 -67.08 0.48 Allowed 'General case' 0 C--N 1.306 -1.288 0 O-C-N 121.345 -0.847 . . . . 0.0 111.146 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.586 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 90.0 m95 -66.23 -40.03 89.99 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.087 -1.008 . . . . 0.0 112.081 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.842 ' HG3' HD23 ' A' ' 12' ' ' LEU . 14.8 mm100 -59.29 -20.83 57.58 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.662 -0.649 . . . . 0.0 110.815 -177.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -89.47 -27.33 20.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.324 -0.86 . . . . 0.0 109.75 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.72 68.84 0.55 Allowed Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.231 -1.548 . . . . 0.0 109.231 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.906 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -120.9 162.61 19.55 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.626 -0.926 . . . . 0.0 109.995 -178.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.5 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -136.22 118.92 1.9 Allowed Glycine 0 N--CA 1.5 2.937 0 C-N-CA 120.264 -0.969 . . . . 0.0 111.586 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.715 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 31.22 -85.36 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 179.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 t -67.68 -53.11 30.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.3 -0.875 . . . . 0.0 110.55 -178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.432 ' CD2' HD12 ' A' ' 19' ' ' LEU . 7.9 t60 -59.06 -26.49 64.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.595 -0.691 . . . . 0.0 110.551 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.906 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.92 -36.44 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.889 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 179.402 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -64.41 -40.9 96.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.718 -0.614 . . . . 0.0 110.105 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -60.72 -34.4 74.35 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.475 -0.765 . . . . 0.0 109.926 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.4 m -71.25 -58.49 3.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.517 -0.739 . . . . 0.0 109.947 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.42 ' HB2' ' CE ' ' A' ' 14' ' ' MET . 23.9 mmt -104.61 -140.83 0.36 Allowed 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.718 ' O ' HG23 ' A' ' 30' ' ' ILE . 1.4 t-20 -137.48 88.21 2.32 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.332 -1.48 . . . . 0.0 111.82 -178.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.891 HD13 HG22 ' A' ' 35' ' ' VAL . 1.1 pp -168.29 153.49 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 O-C-N 121.234 -0.916 . . . . 0.0 110.39 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.821 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -71.69 167.04 20.69 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.715 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 7.1 ppt_? -64.26 -41.47 96.94 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.236 -0.915 . . . . 0.0 111.529 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.04 -30.22 58.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.163 -0.96 . . . . 0.0 108.953 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.3 m -63.93 -34.66 78.47 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.891 HG22 HD13 ' A' ' 30' ' ' ILE . 2.5 t -63.58 -45.03 98.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.577 ' HA ' HD12 ' A' ' 39' ' ' ILE . 14.4 m-85 -62.94 -16.71 60.27 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 120.156 -0.618 . . . . 0.0 111.498 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.4 -39.1 85.56 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 175.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 11' ' ' VAL . 66.3 t -71.49 -60.91 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.034 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.803 HD11 HG12 ' A' ' 35' ' ' VAL . 1.8 mp -55.67 -32.98 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 CA-C-O 121.758 0.79 . . . . 0.0 109.63 -176.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -65.54 -41.68 92.8 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.19 -34.08 76.86 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.714 -0.616 . . . . 0.0 109.476 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.496 1.874 0 O-C-N 121.54 -0.725 . . . . 0.0 109.793 179.957 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 12' ' ' LEU . 31.2 mmt180 . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 120.785 0.326 . . . . 0.0 110.232 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.42 -33.93 73.71 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.284 -0.885 . . . . 0.0 109.674 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.11 72.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.558 -0.714 . . . . 0.0 109.773 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.61 HG12 ' HD1' ' A' ' 15' ' ' TRP . 10.6 t -76.94 -32.34 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 8' ' ' ARG . 0.9 OUTLIER -63.04 -22.74 67.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.469 -0.77 . . . . 0.0 109.427 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -83.5 -45.83 13.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.102 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.701 ' O ' HG23 ' A' ' 24' ' ' ILE . 24.0 ptp -71.03 -3.82 21.68 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.508 -0.745 . . . . 0.0 111.486 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.61 ' HD1' HG12 ' A' ' 11' ' ' VAL . 33.5 m95 -120.57 -42.46 2.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.463 -1.398 . . . . 0.0 111.22 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -78.7 0.67 25.75 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.382 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -103.77 22.71 13.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.097 -1.002 . . . . 0.0 110.041 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.504 ' O ' HD12 ' A' ' 19' ' ' LEU . . . 76.59 63.55 2.32 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.504 HD12 ' O ' ' A' ' 18' ' ' GLY . 0.8 OUTLIER -127.41 160.3 31.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.742 -0.858 . . . . 0.0 110.452 -178.679 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.439 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.5 125.23 1.41 Allowed Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.01 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.5 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 30.1 -84.41 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.1 t -63.92 -52.03 61.7 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.267 -0.896 . . . . 0.0 111.161 -177.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.465 ' CD2' ' CD1' ' A' ' 19' ' ' LEU . 7.3 t60 -61.49 -30.72 70.79 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.446 -0.783 . . . . 0.0 109.834 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.701 HG23 ' O ' ' A' ' 14' ' ' MET . 0.2 OUTLIER -77.26 -24.36 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.942 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.778 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.9 t -58.52 -48.32 81.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.966 -1.083 . . . . 0.0 110.319 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.429 ' NZ ' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -73.9 -36.72 64.78 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.531 -179.239 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.0 m -62.12 -69.56 0.24 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.35 -0.843 . . . . 0.0 109.759 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.439 ' HE1' HG22 ' A' ' 35' ' ' VAL . 1.5 ptt? -80.07 -134.73 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.467 ' O ' HG23 ' A' ' 30' ' ' ILE . 36.2 m-20 -157.69 45.31 0.35 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.368 -1.458 . . . . 0.0 113.1 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.467 HG23 ' O ' ' A' ' 29' ' ' ASN . 14.3 pt -154.25 166.6 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.958 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.426 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -57.21 162.48 2.64 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 110.404 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -72.55 -33.88 67.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.757 -0.589 . . . . 0.0 111.645 -178.825 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.476 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 12.3 p -74.78 -35.54 62.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.022 -1.048 . . . . 0.0 108.775 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 73.7 m -61.26 -33.22 73.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.473 ' C ' HD12 ' A' ' 39' ' ' ILE . 0.5 OUTLIER -65.86 -40.89 88.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 39' ' ' ILE . 12.3 m-85 -67.03 -13.77 62.24 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 119.421 -0.911 . . . . 0.0 110.981 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -69.05 -40.23 78.67 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.16 -1.792 . . . . 0.0 106.16 174.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.48 HG11 HG21 ' A' ' 11' ' ' VAL . 2.3 t -77.87 -56.06 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.282 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 36' ' ' TYR . 4.2 mt -54.17 -34.12 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.407 -0.808 . . . . 0.0 109.316 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.33 -40.96 73.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -60.98 -30.29 70.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.703 -0.623 . . . . 0.0 109.795 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.494 1.772 0 O-C-N 121.93 -0.482 . . . . 0.0 109.827 -179.929 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.726 ' NH2' HD12 ' A' ' 12' ' ' LEU . 7.9 ptt180 . . . . . 0 N--CA 1.507 2.394 0 CA-C-O 121.229 0.537 . . . . 0.0 111.772 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.69 -28.67 61.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.336 -0.852 . . . . 0.0 109.564 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.06 -54.84 5.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.546 -0.721 . . . . 0.0 110.029 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 38' ' ' VAL . 19.0 t -58.78 -40.19 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 109.176 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.726 HD12 ' NH2' ' A' ' 8' ' ' ARG . 5.5 tt -59.2 -39.07 81.48 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -57.44 -33.85 68.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.446 -0.784 . . . . 0.0 109.079 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.902 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.3 mmt -62.59 -45.92 90.65 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.827 -0.546 . . . . 0.0 109.655 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.979 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 32.8 m95 -79.54 -0.27 32.73 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.171 -0.955 . . . . 0.0 111.079 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.58 ' HG3' HD23 ' A' ' 12' ' ' LEU . 7.9 mm100 -100.33 -21.5 15.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.962 -1.086 . . . . 0.0 111.321 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.431 ' HB2' HD11 ' A' ' 19' ' ' LEU . 94.4 mm-40 -95.62 10.61 36.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.133 -0.98 . . . . 0.0 111.362 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.564 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 84.24 65.58 1.52 Allowed Glycine 0 N--CA 1.496 2.642 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.851 HD13 ' O ' ' A' ' 14' ' ' MET . 7.4 mp -124.18 -172.59 2.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.668 -0.901 . . . . 0.0 109.309 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -164.62 120.87 0.97 Allowed Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.002 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.562 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 17.38 -72.45 0.0 OUTLIER 'General case' 0 N--CA 1.522 3.163 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 20' ' ' GLY . 41.6 m -50.61 -59.98 3.5 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.118 -0.989 . . . . 0.0 110.361 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.69 ' CD2' HD23 ' A' ' 19' ' ' LEU . 5.9 t60 -65.65 -38.42 89.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.392 -0.818 . . . . 0.0 109.341 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.902 HG23 ' HB3' ' A' ' 14' ' ' MET . 38.6 mt -72.96 -7.23 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.609 -0.682 . . . . 0.0 110.36 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.454 ' OG ' HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -87.21 -68.62 0.74 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.545 -0.722 . . . . 0.0 110.054 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.758 ' HA ' HG22 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -55.5 -26.17 41.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.623 -0.673 . . . . 0.0 110.685 -179.353 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.621 HG22 ' O ' ' A' ' 23' ' ' HIS . 12.8 t -85.67 -36.57 20.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.495 -0.753 . . . . 0.0 109.942 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.733 ' HG2' HG22 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -141.17 112.89 7.66 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -178.549 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.781 ' O ' HG22 ' A' ' 35' ' ' VAL . 4.3 t-20 40.35 90.08 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.707 -0.621 . . . . 0.0 111.862 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.758 HG22 ' HA ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -58.02 -162.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.679 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.971 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 63.38 105.47 0.03 OUTLIER 'General case' 0 C--O 1.193 -1.876 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.436 ' CD ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 mtm180 -57.62 -52.83 63.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.686 -0.634 . . . . 0.0 111.66 -176.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -57.78 -40.98 81.11 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.112 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 88.3 m -67.57 -31.75 72.03 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.952 0.882 . . . . 0.0 108.938 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.971 HG23 ' O ' ' A' ' 31' ' ' ALA . 89.1 t -66.69 -31.19 52.4 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.89 ' CD1' HD12 ' A' ' 39' ' ' ILE . 16.2 m-85 -76.25 -23.02 54.46 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.368 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -37.85 84.12 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 11' ' ' VAL . 1.3 t -67.94 -52.72 36.35 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.344 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.979 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 4.5 mt -58.43 -36.65 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-O 121.819 0.819 . . . . 0.0 110.052 -176.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -66.05 -36.98 84.71 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -57.15 -21.31 31.8 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.723 -0.611 . . . . 0.0 110.117 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.496 1.843 0 O-C-N 121.349 -0.845 . . . . 0.0 109.949 179.744 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.085 0.469 . . . . 0.0 109.85 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.06 -26.3 66.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.519 -0.738 . . . . 0.0 110.163 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.739 ' HB1' ' SD ' ' A' ' 28' ' ' MET . . . -62.79 -53.07 59.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.467 -0.771 . . . . 0.0 109.915 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.899 HG11 ' CG1' ' A' ' 38' ' ' VAL . 45.4 t -59.43 -34.6 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.287 -0.883 . . . . 0.0 109.387 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 16.1 mt -65.27 -33.48 76.07 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -66.56 -31.02 71.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.164 -0.96 . . . . 0.0 110.562 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.948 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.4 mtm -70.51 -61.04 1.92 Allowed 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.278 -0.889 . . . . 0.0 111.372 -178.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 97.7 m95 -76.33 -42.01 46.49 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.295 -0.878 . . . . 0.0 112.963 -176.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 7.9 mm100 -63.25 -26.42 68.77 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.599 -0.688 . . . . 0.0 110.489 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -78.38 -24.41 46.37 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.311 -0.868 . . . . 0.0 109.807 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.12 63.13 0.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.944 HD22 ' CD2' ' A' ' 23' ' ' HIS . 8.4 mt -119.51 -173.63 2.56 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.932 . . . . 0.0 110.831 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -145.45 116.51 0.91 Allowed Glycine 0 N--CA 1.498 2.832 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.469 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.705 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 10.1 -65.35 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.3 1.592 . . . . 0.0 115.3 178.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.5 m -45.61 -57.44 4.18 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.07 -1.019 . . . . 0.0 110.826 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.944 ' CD2' HD22 ' A' ' 19' ' ' LEU . 10.2 t60 -81.52 -31.0 33.0 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.392 -0.818 . . . . 0.0 109.365 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.948 HG23 ' HB3' ' A' ' 14' ' ' MET . 67.8 mt -61.82 -21.99 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.298 -0.876 . . . . 0.0 110.613 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 p -109.05 -54.45 2.53 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.307 -0.871 . . . . 0.0 110.596 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -24.86 65.1 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.434 -0.791 . . . . 0.0 110.235 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.663 HG21 ' NE2' ' A' ' 23' ' ' HIS . 18.4 m -86.4 -57.01 3.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.453 -0.779 . . . . 0.0 109.828 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.739 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -65.66 -101.97 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.572 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 30' ' ' ILE . 25.7 t-20 -163.58 64.66 0.17 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.551 -1.343 . . . . 0.0 111.039 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.764 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.7 OUTLIER -176.43 -175.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 O-C-N 121.084 -1.01 . . . . 0.0 110.075 179.471 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.936 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -97.83 170.64 8.83 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.55 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -64.4 -46.67 82.26 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 0.0 111.703 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 1.0 OUTLIER -67.88 -36.25 79.92 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.206 -0.934 . . . . 0.0 108.753 -179.605 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.6 m -61.06 -35.23 76.39 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.938 HG12 HD11 ' A' ' 39' ' ' ILE . 12.2 t -64.17 -34.22 67.46 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.309 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 39' ' ' ILE . 13.4 m-85 -75.28 -15.36 60.52 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.397 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.28 -39.42 86.01 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.899 ' CG1' HG11 ' A' ' 11' ' ' VAL . 2.1 t -74.47 -55.01 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.237 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.938 HD11 HG12 ' A' ' 35' ' ' VAL . 6.3 mt -56.03 -33.28 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.407 -0.808 . . . . 0.0 109.631 -177.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.17 -40.6 82.27 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -63.48 -28.1 69.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.79 -0.569 . . . . 0.0 109.586 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.495 1.805 0 O-C-N 121.441 -0.787 . . . . 0.0 109.584 -179.96 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.83 -29.14 60.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.515 -0.74 . . . . 0.0 109.703 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.15 -59.05 3.52 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.579 -0.701 . . . . 0.0 109.678 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.424 HG11 HG11 ' A' ' 38' ' ' VAL . 46.0 t -60.87 -38.4 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.564 -0.71 . . . . 0.0 109.626 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 12' ' ' LEU . 31.9 mt -70.98 -21.72 62.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 110.359 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -71.74 -47.4 54.03 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.999 -1.063 . . . . 0.0 110.709 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.746 ' SD ' HD13 ' A' ' 30' ' ' ILE . 12.7 ptp -73.32 -48.21 36.26 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.295 -0.878 . . . . 0.0 112.339 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.752 ' NE1' HD11 ' A' ' 39' ' ' ILE . 75.3 m95 -65.57 -49.83 67.36 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.653 -1.279 . . . . 0.0 111.686 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 mm-40 -62.81 -25.8 68.43 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.901 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -71.33 -29.57 65.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.315 -0.866 . . . . 0.0 109.114 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.26 50.84 0.21 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HG23 ' A' ' 24' ' ' ILE . 1.7 mp -112.07 168.96 9.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.589 -0.948 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.479 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -153.67 117.76 0.82 Allowed Glycine 0 N--CA 1.498 2.805 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.851 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 34.94 -86.6 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -70.96 -51.65 24.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.174 -0.954 . . . . 0.0 110.236 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -57.39 -30.49 64.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.607 -0.683 . . . . 0.0 110.142 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.768 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -65.43 -39.7 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.752 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.53 -32.42 68.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.703 -0.623 . . . . 0.0 109.84 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -43.78 98.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.573 -0.704 . . . . 0.0 109.162 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.765 ' OG1' HD21 ' A' ' 19' ' ' LEU . 6.4 m -74.1 -66.58 0.7 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.547 -0.72 . . . . 0.0 109.414 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' ILE . 3.4 mtm -117.14 109.97 17.59 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -45.35 102.53 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.706 -0.621 . . . . 0.0 112.063 -178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 1.046 HD12 HG21 ' A' ' 35' ' ' VAL . 35.7 pt -143.79 159.4 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.64 -0.663 . . . . 0.0 109.9 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.749 ' HB3' ' HB ' ' A' ' 34' ' ' THR . . . -85.51 150.75 24.46 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.661 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 33.5 ptt180 -77.57 -46.48 22.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.914 -1.116 . . . . 0.0 111.893 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 47.2 p -71.49 -39.1 71.06 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.18 -0.95 . . . . 0.0 108.577 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.749 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 85.9 m -59.78 -46.84 87.95 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.465 1.126 . . . . 0.0 108.804 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 1.046 HG21 HD12 ' A' ' 30' ' ' ILE . 27.3 t -60.08 -38.68 77.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.454 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.8 m-85 -69.01 -18.94 64.11 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.24 -178.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -61.28 -37.58 83.7 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 174.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.454 HG12 HD13 ' A' ' 39' ' ' ILE . 2.2 t -77.05 -49.13 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.818 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.752 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.6 mm -57.37 -37.61 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.884 -1.135 . . . . 0.0 110.086 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -68.82 -40.25 79.59 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.18 -14.41 62.26 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.838 -0.539 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.497 1.881 0 O-C-N 121.144 -0.973 . . . . 0.0 109.568 -179.914 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 121.049 0.452 . . . . 0.0 109.99 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.431 ' HA ' HD12 ' A' ' 12' ' ' LEU . 21.5 t70 -70.33 -23.95 62.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.413 -0.804 . . . . 0.0 109.88 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.75 -54.31 37.33 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 109.768 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.607 ' CB ' HG11 ' A' ' 38' ' ' VAL . 56.7 t -58.07 -39.91 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.471 -0.768 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 9' ' ' ASP . 95.6 mt -59.7 -37.75 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.68 -0.637 . . . . 0.0 109.777 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -65.87 -28.13 68.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.59 -0.693 . . . . 0.0 109.968 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.786 ' O ' HD22 ' A' ' 19' ' ' LEU . 25.4 mmt -63.97 -52.86 57.69 Favored 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.388 -0.82 . . . . 0.0 109.766 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.677 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 86.5 m95 -63.93 -31.81 73.12 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.257 -0.902 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -67.58 -18.87 65.15 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.804 -0.56 . . . . 0.0 110.713 -178.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -95.91 14.12 24.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.263 -0.898 . . . . 0.0 110.663 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.28 63.06 2.45 Favored Glycine 0 N--CA 1.495 2.611 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -118.43 153.98 33.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.697 -0.884 . . . . 0.0 110.293 -179.224 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -141.32 121.8 1.95 Allowed Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.349 -0.929 . . . . 0.0 110.961 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.656 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.18 -84.78 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.3 m -64.12 -54.14 38.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.334 -0.854 . . . . 0.0 111.097 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.15 -32.79 71.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.801 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -64.36 -32.68 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.076 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -69.93 -27.71 64.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.661 -0.65 . . . . 0.0 109.496 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -47.61 83.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.283 -0.886 . . . . 0.0 109.031 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -74.16 -64.1 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.577 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -98.98 98.06 9.15 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.017 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -52.15 89.26 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.664 -0.647 . . . . 0.0 112.334 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.47 HD12 ' O ' ' A' ' 28' ' ' MET . 0.1 OUTLIER -151.39 161.99 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.172 -0.955 . . . . 0.0 109.111 177.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.556 ' HB3' ' OG1' ' A' ' 34' ' ' THR . . . -72.41 158.83 35.02 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.341 -0.849 . . . . 0.0 109.429 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -67.84 -42.33 81.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.55 -0.719 . . . . 0.0 111.213 -179.06 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.426 ' N ' ' HD2' ' A' ' 32' ' ' ARG . 3.3 p -72.46 -32.84 66.58 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.064 -1.022 . . . . 0.0 108.37 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.556 ' OG1' ' HB3' ' A' ' 31' ' ' ALA . 89.6 m -62.23 -30.28 70.98 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.562 ' O ' HD12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -68.23 -40.54 82.88 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.664 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.716 ' HA ' HD12 ' A' ' 39' ' ' ILE . 20.3 m-85 -67.1 -11.98 58.7 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.762 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -74.58 -39.06 62.48 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.607 HG11 ' CB ' ' A' ' 11' ' ' VAL . 2.4 t -78.7 -54.38 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.147 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.716 HD12 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mt -55.69 -38.13 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.906 -177.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -66.04 -40.84 91.33 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -61.76 -28.89 69.77 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.708 -0.62 . . . . 0.0 109.754 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.5 -0.75 . . . . 0.0 109.528 -179.897 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.464 -1.454 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.2 mtt180 -92.76 -73.95 0.54 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.563 -0.963 . . . . 0.0 109.534 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.84 43.75 1.62 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.533 -0.729 . . . . 0.0 109.511 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.5 mtp180 -92.43 -79.65 0.38 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.486 -0.759 . . . . 0.0 109.508 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.3 tptt -114.56 78.38 1.15 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.43 -0.793 . . . . 0.0 109.455 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.4 ' O ' HD12 ' A' ' 6' ' ' ILE . 2.6 pp -153.79 147.39 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.456 -0.778 . . . . 0.0 109.575 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -89.14 170.46 10.61 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.616 -0.677 . . . . 0.0 109.335 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 179.36 -38.62 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.526 -0.734 . . . . 0.0 109.473 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -70.38 -24.6 62.98 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.572 -0.705 . . . . 0.0 109.948 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.65 -67.19 0.42 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.426 -0.796 . . . . 0.0 109.997 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.633 HG21 HG11 ' A' ' 38' ' ' VAL . 20.7 t -65.45 -32.39 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.5 -0.75 . . . . 0.0 109.643 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.488 ' O ' HD23 ' A' ' 12' ' ' LEU . 8.7 tt -61.03 -22.49 64.61 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.588 -0.695 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -92.86 -44.05 8.68 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.825 ' O ' HD13 ' A' ' 19' ' ' LEU . 1.7 mpp? -61.69 -14.1 28.61 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.462 -0.774 . . . . 0.0 111.615 -179.047 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.864 ' NE1' HD11 ' A' ' 39' ' ' ILE . 69.0 m95 -113.0 -42.72 3.51 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 120.725 -1.235 . . . . 0.0 110.869 -179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -75.64 -3.96 37.48 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.527 -176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -95.36 -29.3 14.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.089 -1.007 . . . . 0.0 109.519 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.94 75.94 0.42 Allowed Glycine 0 N--CA 1.496 2.694 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.825 HD13 ' O ' ' A' ' 14' ' ' MET . 4.9 mp -133.25 -173.43 3.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.483 -1.01 . . . . 0.0 110.031 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.61 116.97 0.74 Allowed Glycine 0 N--CA 1.491 2.33 0 C-N-CA 119.911 -1.138 . . . . 0.0 111.03 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.651 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.01 -84.72 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 22.0 t -61.76 -56.4 19.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.322 -0.861 . . . . 0.0 110.667 -178.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -57.92 -27.6 63.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.482 -0.761 . . . . 0.0 110.533 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.706 HG22 ' HE2' ' A' ' 28' ' ' MET . 0.3 OUTLIER -72.45 -39.01 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.806 0 C-N-CA 119.208 -0.997 . . . . 0.0 108.65 -179.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 99.1 p -65.2 -46.32 81.22 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.695 -0.628 . . . . 0.0 110.052 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.82 -28.14 67.21 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.512 -0.743 . . . . 0.0 109.829 -179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.1 m -79.32 -38.46 35.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.528 -0.732 . . . . 0.0 110.361 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.706 ' HE2' HG22 ' A' ' 24' ' ' ILE . 2.6 ptt? -110.27 -153.22 0.51 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.441 ' O ' HG23 ' A' ' 30' ' ' ILE . 8.4 p-10 -120.4 46.75 1.91 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.263 -0.898 . . . . 0.0 112.315 -177.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.684 ' CD1' HG22 ' A' ' 35' ' ' VAL . 15.4 pt -153.91 148.58 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 120.801 -1.187 . . . . 0.0 110.636 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.695 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -62.73 174.28 1.08 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.653 -0.654 . . . . 0.0 109.836 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.594 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -75.61 -41.48 54.33 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.473 -0.767 . . . . 0.0 111.662 -178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.411 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 4.9 t -68.93 -37.42 78.89 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.4 m -64.06 -37.3 86.93 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 31' ' ' ALA . 14.4 t -60.37 -41.2 86.42 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.7 m-85 -70.25 -18.42 63.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.973 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -59.98 -36.63 77.55 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 174.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.633 HG11 HG21 ' A' ' 11' ' ' VAL . 17.4 t -72.82 -57.44 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.449 178.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.864 HD11 ' NE1' ' A' ' 15' ' ' TRP . 6.0 mm -52.98 -31.35 17.04 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 CA-C-O 121.837 0.827 . . . . 0.0 110.61 -176.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -74.34 -41.0 61.79 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -60.65 -33.31 72.63 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.709 -0.619 . . . . 0.0 109.796 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.8 m 59.57 29.8 19.39 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.49 -0.756 . . . . 0.0 109.725 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.491 179.997 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -90.76 -172.69 3.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.553 -0.969 . . . . 0.0 109.488 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 20.1 mtpp -84.6 90.61 7.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.68 . . . . 0.0 109.502 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -118.42 36.32 4.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.575 -0.703 . . . . 0.0 109.448 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.0 mtmt -99.73 -65.56 0.96 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.565 -0.71 . . . . 0.0 109.504 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.774 HG23 ' NH1' ' A' ' 8' ' ' ARG . 1.7 mp -88.16 74.43 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.35 79.65 1.4 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.774 ' NH1' HG23 ' A' ' 6' ' ' ILE . 1.4 mpp_? -97.48 32.94 2.12 Favored 'General case' 0 N--CA 1.483 1.194 0 O-C-N 121.607 -0.683 . . . . 0.0 109.709 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.61 -22.67 65.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.559 -0.713 . . . . 0.0 109.976 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.94 -50.86 30.03 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.408 -0.807 . . . . 0.0 109.769 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.554 ' CG1' HG13 ' A' ' 35' ' ' VAL . 46.8 t -60.65 -44.65 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.504 -0.747 . . . . 0.0 109.429 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.555 HD13 ' OG ' ' A' ' 42' ' ' SER . 6.8 tp -63.55 -30.97 72.01 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.779 -0.576 . . . . 0.0 109.786 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -66.26 -30.71 71.2 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.377 -0.827 . . . . 0.0 110.142 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.511 ' O ' HD22 ' A' ' 19' ' ' LEU . 6.6 mmt -70.89 -56.48 6.18 Favored 'General case' 0 C--N 1.308 -1.211 0 O-C-N 121.429 -0.794 . . . . 0.0 110.285 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CE2' HG21 ' A' ' 24' ' ' ILE . 98.3 m95 -58.86 -40.03 83.12 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.318 -0.864 . . . . 0.0 111.494 -178.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -67.95 -16.31 64.0 Favored 'General case' 0 C--N 1.298 -1.654 0 O-C-N 121.823 -0.548 . . . . 0.0 111.891 -176.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.424 ' HB2' HD13 ' A' ' 19' ' ' LEU . 72.0 mt-30 -94.82 22.04 6.86 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.161 -0.962 . . . . 0.0 110.773 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.728 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 72.95 54.08 7.42 Favored Glycine 0 N--CA 1.5 2.939 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.728 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.5 mp -122.91 -170.8 2.17 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.629 -0.924 . . . . 0.0 108.938 -179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.548 ' N ' HG12 ' A' ' 24' ' ' ILE . . . 178.39 116.13 0.48 Allowed Glycine 0 N--CA 1.499 2.864 0 C-N-CA 119.376 -1.392 . . . . 0.0 112.899 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.458 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 32.55 -78.98 0.0 OUTLIER 'General case' 0 N--CA 1.52 3.067 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.484 ' N ' ' O ' ' A' ' 20' ' ' GLY . 29.6 t -44.16 -42.51 6.45 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.331 -0.856 . . . . 0.0 109.51 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.61 ' CD2' HD23 ' A' ' 19' ' ' LEU . 7.2 t60 -94.57 -29.47 14.87 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 177.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.743 HG21 ' CE2' ' A' ' 15' ' ' TRP . 16.6 mm -76.19 8.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 121.217 -0.927 . . . . 0.0 110.762 178.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.7 m -137.4 -35.13 0.68 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.052 -1.03 . . . . 0.0 111.05 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.36 -36.22 16.71 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.833 -1.167 . . . . 0.0 110.305 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 32.2 m -91.39 -28.84 17.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.42 -0.8 . . . . 0.0 111.301 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.459 ' CB ' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -101.01 34.18 2.59 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.232 -0.917 . . . . 0.0 109.402 -178.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.518 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.9 p-10 33.95 58.64 0.59 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 177.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.799 HD12 ' CG2' ' A' ' 35' ' ' VAL . 6.0 pt -157.79 172.76 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.065 0 O-C-N 121.524 -0.735 . . . . 0.0 109.054 178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.465 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -96.69 156.4 16.36 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.41 ' HG3' ' N ' ' A' ' 33' ' ' SER . 8.2 ptp180 -78.0 -45.93 22.42 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.848 -1.158 . . . . 0.0 111.53 -178.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -63.99 -42.25 97.25 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.11 -0.994 . . . . 0.0 108.943 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.2 m -63.68 -44.84 92.55 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 122.574 1.178 . . . . 0.0 108.236 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.926 HG12 HD11 ' A' ' 39' ' ' ILE . 12.0 t -63.4 -21.5 28.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.735 ' HA ' HD12 ' A' ' 39' ' ' ILE . 2.1 m-85 -79.08 -24.54 43.43 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.21 -0.931 . . . . 0.0 110.137 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 mtpt -61.96 -37.45 84.8 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.86 -54.28 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.997 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.926 HD11 HG12 ' A' ' 35' ' ' VAL . 12.2 mt -53.99 -30.74 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 O-C-N 121.449 -0.782 . . . . 0.0 110.077 -178.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.0 t30 -72.69 -41.19 65.56 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -95.97 22.58 7.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.773 -0.579 . . . . 0.0 109.863 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.555 ' OG ' HD13 ' A' ' 12' ' ' LEU . 25.6 t -118.79 -39.58 2.95 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 109.423 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 117.988 -1.006 . . . . 0.0 109.448 -179.959 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -65.97 135.6 54.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.578 -0.954 . . . . 0.0 109.513 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.66 95.97 8.3 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.563 -0.71 . . . . 0.0 109.367 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.35 71.79 0.84 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.532 -0.73 . . . . 0.0 109.534 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.4 pttp -60.33 -27.31 67.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.342 -0.849 . . . . 0.0 109.953 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.542 HG22 ' N ' ' A' ' 7' ' ' ASP . 52.2 mt -61.41 165.32 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.558 -0.714 . . . . 0.0 109.59 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.542 ' N ' HG22 ' A' ' 6' ' ' ILE . 3.9 t70 -85.7 101.75 13.02 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 -160.21 44.48 0.21 Allowed 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -71.13 -23.33 62.06 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.626 -0.671 . . . . 0.0 109.972 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.798 ' HB1' ' HE1' ' A' ' 28' ' ' MET . . . -62.34 -55.74 25.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.388 -0.82 . . . . 0.0 109.731 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.607 HG22 ' SD ' ' A' ' 28' ' ' MET . 40.8 t -66.89 -42.1 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.493 -0.755 . . . . 0.0 109.285 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.75 -26.45 61.85 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.567 -0.708 . . . . 0.0 109.946 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -86.8 -32.64 20.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.367 -0.833 . . . . 0.0 109.357 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.646 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -82.64 5.11 22.19 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.623 -0.673 . . . . 0.0 111.141 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.595 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 10.1 m95 -128.24 -49.47 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 122.386 1.089 . . . . 0.0 109.691 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -73.06 -15.25 61.51 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.008 -176.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -80.16 -27.68 38.94 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.191 -0.943 . . . . 0.0 109.48 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 120.77 65.85 0.26 Allowed Glycine 0 N--CA 1.496 2.64 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.852 HD23 ' CD2' ' A' ' 23' ' ' HIS . 4.9 mp -127.98 -171.74 2.52 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.497 -1.002 . . . . 0.0 110.158 -179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.439 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -154.55 112.21 0.52 Allowed Glycine 0 N--CA 1.496 2.677 0 C-N-CA 119.647 -1.263 . . . . 0.0 111.777 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 16.25 -74.31 0.0 OUTLIER 'General case' 0 N--CA 1.521 3.076 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.439 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.4 p -48.65 -59.35 3.59 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.179 -0.951 . . . . 0.0 110.776 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.852 ' CD2' HD23 ' A' ' 19' ' ' LEU . 6.1 t60 -64.93 -37.51 87.89 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.775 HD12 ' N ' ' A' ' 21' ' ' ALA . 78.8 mt -66.73 -14.02 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.813 -0.554 . . . . 0.0 110.283 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.7 p -81.18 -40.79 23.36 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 108.789 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' N ' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -66.18 -55.33 16.84 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.453 HG23 ' N ' ' A' ' 28' ' ' MET . 4.1 t -62.64 -48.24 80.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.638 -0.664 . . . . 0.0 109.461 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.798 ' HE1' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -107.44 93.57 4.62 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 178.506 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.735 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.0 t-20 -47.94 96.36 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.06 HD12 HG22 ' A' ' 35' ' ' VAL . 1.2 pt -172.01 147.95 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.197 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.955 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -61.27 155.92 19.92 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 179.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.808 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -64.31 -35.2 80.08 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.185 -0.947 . . . . 0.0 111.244 -178.361 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 86.9 p -75.42 -36.73 60.73 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.144 -0.973 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.7 m -61.8 -34.96 76.85 Favored 'General case' 0 N--CA 1.49 1.543 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 1.06 HG22 HD12 ' A' ' 30' ' ' ILE . 8.9 t -66.08 -34.79 72.61 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.39 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 39' ' ' ILE . 16.1 m-85 -75.25 -13.3 60.43 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.85 179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -68.98 -38.4 79.3 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 106.037 -1.838 . . . . 0.0 106.037 174.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.4 HG11 HG11 ' A' ' 11' ' ' VAL . 2.1 t -76.7 -54.38 13.28 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.094 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.908 HD11 HG12 ' A' ' 35' ' ' VAL . 5.6 mt -56.07 -34.26 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 121.414 -0.804 . . . . 0.0 109.563 -177.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -69.79 -40.71 75.85 Favored 'General case' 0 C--N 1.301 -1.517 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -59.94 -28.75 67.89 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.923 -0.485 . . . . 0.0 109.773 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 19.2 m -68.28 -58.64 4.09 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.53 -0.731 . . . . 0.0 109.346 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.992 -1.004 . . . . 0.0 109.495 179.987 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -58.76 -22.69 58.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.488 -1.007 . . . . 0.0 110.404 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -73.61 -35.99 65.43 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.404 -0.81 . . . . 0.0 109.501 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.14 179.26 0.42 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.588 -0.695 . . . . 0.0 109.401 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.15 138.85 57.41 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.528 -0.733 . . . . 0.0 110.059 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.674 HD12 ' O ' ' A' ' 7' ' ' ASP . 2.4 pp -136.54 -174.74 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.546 -0.721 . . . . 0.0 109.547 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.674 ' O ' HD12 ' A' ' 6' ' ' ILE . 6.1 t0 -54.34 159.93 1.83 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.402 -0.811 . . . . 0.0 110.638 -179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.87 26.57 13.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.556 -0.715 . . . . 0.0 110.042 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -62.27 -31.05 71.57 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.521 -0.737 . . . . 0.0 109.858 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.53 -42.04 98.45 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.585 -0.697 . . . . 0.0 109.881 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 38' ' ' VAL . 45.8 t -62.6 -49.28 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.529 -0.732 . . . . 0.0 109.076 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.65 -8.71 57.22 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.733 -0.604 . . . . 0.0 110.486 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -38.03 48.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.866 -1.147 . . . . 0.0 109.748 -179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.542 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.9 mmt -83.66 -45.26 13.64 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.495 -0.753 . . . . 0.0 110.45 -179.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.743 ' CH2' HD11 ' A' ' 24' ' ' ILE . 35.0 m95 -55.14 -51.24 67.08 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 120.924 -1.11 . . . . 0.0 110.14 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -63.68 -28.27 69.79 Favored 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.472 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -73.89 -29.31 62.0 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.281 -0.887 . . . . 0.0 109.318 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.94 65.32 0.23 Allowed Glycine 0 N--CA 1.496 2.645 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.803 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.6 OUTLIER -133.47 160.56 37.05 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.446 -1.032 . . . . 0.0 109.963 -179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.48 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -138.59 121.91 2.26 Favored Glycine 0 N--CA 1.497 2.717 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.484 -179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.653 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 28.45 -83.4 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.489 0 N-CA-C 114.383 1.253 . . . . 0.0 114.383 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.5 t -64.43 -56.35 14.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.411 -0.806 . . . . 0.0 111.235 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.675 ' CD2' HD23 ' A' ' 19' ' ' LEU . 82.1 t60 -57.04 -30.03 63.9 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.369 -0.832 . . . . 0.0 110.21 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.803 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.49 -34.61 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.7 p -62.78 -34.58 77.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.634 -0.666 . . . . 0.0 109.331 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -34.83 78.8 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.41 ' O ' ' HE3' ' A' ' 28' ' ' MET . 2.2 m -88.89 -76.42 0.4 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.823 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.436 ' HE2' ' HA ' ' A' ' 28' ' ' MET . 19.1 mmt -155.79 82.78 1.02 Allowed 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.282 -0.886 . . . . 0.0 110.032 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.85 ' OD1' HG11 ' A' ' 35' ' ' VAL . 1.6 t-20 -152.74 -41.75 0.1 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.726 -1.234 . . . . 0.0 112.756 -178.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 29' ' ' ASN . 0.2 OUTLIER 50.75 145.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.517 2.915 0 CA-C-O 121.834 0.826 . . . . 0.0 112.359 -177.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.715 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 40.03 97.27 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.684 -0.635 . . . . 0.0 111.248 179.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.653 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -68.61 -42.53 77.98 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.969 -1.082 . . . . 0.0 112.535 -177.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 70.8 m -63.72 -43.9 95.18 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.045 -1.035 . . . . 0.0 108.845 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 86.9 m -63.1 -36.22 82.86 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 122.176 0.988 . . . . 0.0 108.617 178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.895 HG12 HD11 ' A' ' 39' ' ' ILE . 38.0 t -65.2 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.736 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.6 m-85 -75.48 -21.0 58.43 Favored 'General case' 0 N--CA 1.499 1.978 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -64.18 -36.23 83.39 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 175.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.659 HG11 HG11 ' A' ' 11' ' ' VAL . 3.2 t -74.41 -56.12 10.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 CA-C-N 115.041 -0.981 . . . . 0.0 111.162 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.895 HD11 HG12 ' A' ' 35' ' ' VAL . 5.7 mt -55.53 -32.49 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.356 -0.84 . . . . 0.0 109.828 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -69.75 -40.4 76.15 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -62.73 -30.26 71.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.769 -0.582 . . . . 0.0 109.569 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 2.1 t -95.76 82.59 3.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.626 -0.671 . . . . 0.0 109.437 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.981 -1.009 . . . . 0.0 109.474 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.4 ptt180 -58.83 165.0 2.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.533 -0.981 . . . . 0.0 110.12 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -62.57 128.44 36.01 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.584 -0.697 . . . . 0.0 109.664 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -107.15 -77.85 0.59 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.615 -0.678 . . . . 0.0 109.304 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.46 168.3 19.52 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.319 -0.863 . . . . 0.0 109.828 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.4 mm 60.34 105.97 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.58 -0.7 . . . . 0.0 109.875 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -86.76 151.0 23.76 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.522 -0.736 . . . . 0.0 109.297 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -57.92 -37.62 74.4 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.487 -0.758 . . . . 0.0 109.986 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -68.17 -33.96 75.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.586 -0.696 . . . . 0.0 109.424 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.86 70.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.595 -0.69 . . . . 0.0 109.425 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 38' ' ' VAL . 47.0 t -65.35 -50.69 71.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.01 -23.81 67.47 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.669 -0.644 . . . . 0.0 109.718 179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -63.28 -45.32 91.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.169 -0.957 . . . . 0.0 109.698 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 9.6 mmt -64.27 -43.11 95.84 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.463 -0.773 . . . . 0.0 110.025 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.651 ' CE2' HG21 ' A' ' 24' ' ' ILE . 80.0 m95 -67.78 -25.02 65.4 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.003 -1.061 . . . . 0.0 112.184 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 41.3 mm-40 -97.1 13.12 30.27 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.535 -0.728 . . . . 0.0 112.476 -174.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.488 ' HB2' HD21 ' A' ' 19' ' ' LEU . 20.6 mm-40 -105.85 -22.25 12.97 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.073 -1.017 . . . . 0.0 110.562 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 139.44 -49.68 0.81 Allowed Glycine 0 N--CA 1.498 2.785 0 N-CA-C 108.42 -1.872 . . . . 0.0 108.42 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 1.124 HD12 HD13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -48.47 173.78 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 122.015 -0.697 . . . . 0.0 110.979 179.046 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.511 ' HA2' HG13 ' A' ' 24' ' ' ILE . . . -167.45 135.64 3.75 Favored Glycine 0 N--CA 1.491 2.361 0 C-N-CA 119.954 -1.117 . . . . 0.0 111.503 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.584 ' HB1' ' CB ' ' A' ' 32' ' ' ARG . . . 36.68 -83.41 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 177.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.442 ' N ' ' O ' ' A' ' 20' ' ' GLY . 2.9 m -47.99 -52.26 20.51 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.383 -0.823 . . . . 0.0 109.468 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.881 ' CD2' HD13 ' A' ' 19' ' ' LEU . 4.9 t60 -78.77 -31.65 46.22 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 177.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 1.124 HD13 HD12 ' A' ' 19' ' ' LEU . 19.1 mm -71.7 1.73 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 121.284 -0.885 . . . . 0.0 110.525 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.1 t -110.64 -67.02 1.02 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.835 -1.165 . . . . 0.0 110.031 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.55 -26.43 68.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.614 -0.679 . . . . 0.0 110.555 -178.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.602 HG21 ' NE2' ' A' ' 23' ' ' HIS . 7.5 m -90.89 -37.33 13.63 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.35 -0.844 . . . . 0.0 111.424 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.753 ' HE1' HG22 ' A' ' 24' ' ' ILE . 48.9 ttp -91.5 -80.12 0.36 Allowed 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.138 -0.976 . . . . 0.0 109.972 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.472 ' O ' HG23 ' A' ' 30' ' ' ILE . 57.7 t30 -137.25 -61.35 0.65 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.017 -1.052 . . . . 0.0 113.079 -177.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.668 HD13 ' HB ' ' A' ' 34' ' ' THR . 1.4 pp -155.0 -177.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.987 -1.07 . . . . 0.0 112.279 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -34.92 142.14 0.05 Allowed 'General case' 0 N--CA 1.505 2.295 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.34 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.584 ' CB ' ' HB1' ' A' ' 21' ' ' ALA . 1.6 ptt180 -65.76 -22.2 66.57 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.92 -0.487 . . . . 0.0 111.895 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 48.1 t -64.22 -50.63 67.26 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.668 ' HB ' HD13 ' A' ' 30' ' ' ILE . 81.9 m -63.92 -38.93 92.9 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 122.487 1.137 . . . . 0.0 107.975 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.934 HG12 HD11 ' A' ' 39' ' ' ILE . 39.7 t -61.69 -26.35 39.47 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.446 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.666 ' HA ' HD12 ' A' ' 39' ' ' ILE . 6.5 m-85 -78.59 -23.99 45.68 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.569 -0.707 . . . . 0.0 110.395 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -38.27 83.54 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 175.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.778 HG11 HG11 ' A' ' 11' ' ' VAL . 2.2 t -76.5 -53.61 14.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.421 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.934 HD11 HG12 ' A' ' 35' ' ' VAL . 14.8 mt -53.35 -30.76 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.425 -0.797 . . . . 0.0 110.183 -177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -75.5 -42.49 52.71 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -61.49 -23.28 65.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.846 -0.534 . . . . 0.0 110.009 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 73.06 -82.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.572 -0.705 . . . . 0.0 109.692 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.7 p30 . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 117.892 -1.052 . . . . 0.0 109.498 179.969 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -91.17 -41.33 11.06 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.566 -0.961 . . . . 0.0 109.423 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.3 mmmt -75.51 150.8 38.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.581 -0.7 . . . . 0.0 109.46 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.53 31.55 3.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.585 -0.697 . . . . 0.0 109.439 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.667 ' HE2' HD11 ' A' ' 6' ' ' ILE . 20.4 tttt -102.43 -67.55 0.87 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.559 -0.713 . . . . 0.0 109.501 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.667 HD11 ' HE2' ' A' ' 5' ' ' LYS . 41.4 mm -93.42 89.81 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.575 -0.703 . . . . 0.0 109.469 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -105.78 137.1 44.22 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.591 -0.693 . . . . 0.0 109.581 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -157.0 31.59 0.3 Allowed 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -82.06 -20.13 38.88 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.583 -0.698 . . . . 0.0 110.226 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.41 67.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.29 -0.881 . . . . 0.0 109.805 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 61.6 t -76.48 -53.35 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 O-C-N 121.538 -0.726 . . . . 0.0 109.611 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.576 HD13 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -55.23 -40.33 70.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.603 -0.686 . . . . 0.0 110.742 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -76.86 -40.87 46.15 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.663 -0.648 . . . . 0.0 111.991 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.743 ' C ' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -85.1 10.11 13.0 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.071 -1.018 . . . . 0.0 111.632 -178.177 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.868 ' NE1' HD11 ' A' ' 39' ' ' ILE . 6.4 m95 -121.52 -53.1 2.01 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.842 -1.161 . . . . 0.0 109.9 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.576 ' HG3' HD13 ' A' ' 12' ' ' LEU . 18.2 mm-40 -76.79 -16.84 59.34 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.157 -175.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -74.21 -27.22 60.69 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.205 -0.934 . . . . 0.0 109.104 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.583 ' O ' HD13 ' A' ' 19' ' ' LEU . . . 128.49 66.93 0.12 Allowed Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.743 HD23 ' C ' ' A' ' 14' ' ' MET . 2.6 mm? -126.02 -173.43 2.85 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.46 -1.023 . . . . 0.0 110.645 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -170.24 112.79 0.48 Allowed Glycine 0 N--CA 1.49 2.26 0 C-N-CA 120.156 -1.021 . . . . 0.0 110.933 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.611 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 27.32 -83.65 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 178.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.8 m -60.61 -56.57 19.78 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.3 -0.875 . . . . 0.0 110.791 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.695 ' CD2' HD12 ' A' ' 19' ' ' LEU . 7.4 t60 -58.02 -30.51 66.17 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.375 -0.828 . . . . 0.0 110.218 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.655 HG23 ' O ' ' A' ' 14' ' ' MET . 0.3 OUTLIER -67.97 -36.36 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.772 0 N-CA-C 107.245 -1.391 . . . . 0.0 107.245 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.8 t -59.66 -29.94 68.41 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.475 -0.765 . . . . 0.0 109.285 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.36 -52.07 50.7 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.595 -0.691 . . . . 0.0 109.142 179.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.417 HG21 ' HG3' ' A' ' 14' ' ' MET . 54.6 m -74.23 -72.3 0.29 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.504 ' HE2' ' HB2' ' A' ' 14' ' ' MET . 1.9 ttm -80.93 99.01 8.15 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 106.761 -1.57 . . . . 0.0 106.761 178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' HG23 ' A' ' 30' ' ' ILE . 13.7 t30 -57.57 88.02 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.958 -0.464 . . . . 0.0 111.076 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.708 HD13 HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -160.51 160.97 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 O-C-N 121.463 -0.773 . . . . 0.0 110.04 178.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.59 151.53 47.16 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.574 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 5.1 ptt-85 -75.44 -43.36 50.11 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.358 -0.839 . . . . 0.0 111.459 -178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -63.82 -43.17 97.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 109.183 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.3 m -57.73 -43.37 85.26 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 122.711 1.243 . . . . 0.0 108.323 178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.708 HG21 HD13 ' A' ' 30' ' ' ILE . 3.2 t -58.93 -37.43 67.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.481 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 4.1 m-85 -71.02 -22.33 62.16 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.478 -0.889 . . . . 0.0 111.43 -178.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.3 mppp? -59.12 -36.36 75.05 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 175.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.7 t -71.74 -55.52 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.419 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.868 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.4 mm -53.36 -31.84 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.255 0 CA-C-O 121.842 0.83 . . . . 0.0 110.622 -176.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -71.83 -41.93 67.59 Favored 'General case' 0 C--N 1.288 -2.092 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -91.38 16.67 9.7 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.709 -0.619 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.0 m -166.13 76.85 0.23 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 109.427 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.437 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -59.29 114.4 2.63 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.504 -0.998 . . . . 0.0 109.991 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -59.82 -170.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.526 -0.734 . . . . 0.0 109.977 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -104.32 144.96 30.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.555 -0.716 . . . . 0.0 109.462 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -60.2 166.67 2.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.527 -0.733 . . . . 0.0 109.995 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.9 mm -96.84 97.59 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.595 -0.691 . . . . 0.0 109.317 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -104.42 53.32 0.74 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.567 -0.708 . . . . 0.0 109.474 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.614 ' O ' HD13 ' A' ' 12' ' ' LEU . 9.8 mmt180 61.05 68.23 0.75 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.344 -0.848 . . . . 0.0 109.459 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -69.23 -23.22 63.85 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.524 -0.735 . . . . 0.0 109.828 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.44 -61.7 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.461 -0.775 . . . . 0.0 109.695 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 38' ' ' VAL . 26.5 t -57.99 -34.17 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.468 -0.77 . . . . 0.0 109.762 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 8' ' ' ARG . 5.7 mp -67.03 -35.52 80.06 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -65.09 -27.82 69.03 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.352 -0.843 . . . . 0.0 109.686 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.601 ' HB3' HG23 ' A' ' 24' ' ' ILE . 45.1 mtt -69.36 -65.87 0.66 Allowed 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.472 -0.767 . . . . 0.0 110.38 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 88.7 m95 -68.88 -16.09 63.67 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.442 -0.786 . . . . 0.0 112.861 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -93.08 -0.93 56.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 112.275 -177.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -111.03 22.24 15.51 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.998 -1.064 . . . . 0.0 110.751 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.726 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 74.01 55.5 5.77 Favored Glycine 0 N--CA 1.501 3.016 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.726 HD12 ' C ' ' A' ' 18' ' ' GLY . 8.6 mp -123.61 -168.68 1.82 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.546 -0.973 . . . . 0.0 109.261 -179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.508 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -177.94 116.47 0.54 Allowed Glycine 0 N--CA 1.497 2.756 0 C-N-CA 119.701 -1.238 . . . . 0.0 112.175 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.436 ' HA ' ' HB ' ' A' ' 24' ' ' ILE . . . 30.6 -79.33 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.976 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -45.62 -54.6 7.46 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.485 -0.759 . . . . 0.0 109.435 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.505 ' CD2' ' CD2' ' A' ' 19' ' ' LEU . 6.8 t60 -76.64 -32.64 58.12 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.623 HD11 ' HB2' ' A' ' 19' ' ' LEU . 16.9 mm -70.67 0.85 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 O-C-N 121.428 -0.795 . . . . 0.0 110.676 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.408 ' CB ' ' N ' ' A' ' 32' ' ' ARG . 51.9 p -138.19 -0.27 2.05 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.976 -1.077 . . . . 0.0 111.958 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -117.3 -39.7 3.16 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 120.891 -1.131 . . . . 0.0 108.312 -179.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.404 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 59.9 m -90.53 -27.43 19.18 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.607 -0.683 . . . . 0.0 109.182 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.443 ' HG3' ' CG ' ' A' ' 14' ' ' MET . 4.0 mmm -81.38 -125.79 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.435 ' H ' HD13 ' A' ' 30' ' ' ILE . 4.1 m120 -143.26 26.67 1.63 Allowed 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 121.265 1.848 . . . . 0.0 113.364 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.661 ' N ' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -156.49 -177.16 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.43 0 O-C-N 120.676 -1.265 . . . . 0.0 110.952 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.962 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -87.71 152.57 22.04 Favored 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.408 ' N ' ' CB ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -63.85 -39.9 95.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.188 -0.945 . . . . 0.0 112.178 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.6 t -61.7 -44.37 97.07 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.187 -0.946 . . . . 0.0 109.084 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.7 m -62.69 -35.65 80.4 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-O 122.121 0.962 . . . . 0.0 108.583 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.976 HG12 HD11 ' A' ' 39' ' ' ILE . 43.9 t -63.99 -30.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.717 ' HA ' HD12 ' A' ' 39' ' ' ILE . 7.1 m-85 -75.99 -20.35 57.93 Favored 'General case' 0 N--CA 1.499 1.999 0 C-N-CA 119.81 -0.756 . . . . 0.0 110.413 179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -63.18 -37.37 86.97 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 175.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.897 HG11 HG11 ' A' ' 11' ' ' VAL . 2.3 t -77.82 -54.13 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.605 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.976 HD11 HG12 ' A' ' 35' ' ' VAL . 6.8 mt -55.03 -33.02 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 121.306 -0.871 . . . . 0.0 109.838 -177.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -74.45 -39.71 62.37 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -97.94 23.65 7.82 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.906 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 73.4 m -149.88 88.35 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.45 -0.781 . . . . 0.0 109.49 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 117.931 -1.033 . . . . 0.0 109.512 179.953 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -64.29 -71.47 0.18 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.531 -0.981 . . . . 0.0 109.485 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.5 mttt -112.15 146.98 37.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.647 -0.658 . . . . 0.0 109.489 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -22.55 52.35 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 110.358 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -86.49 155.0 20.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.4 -0.813 . . . . 0.0 109.428 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.6 ' O ' HD12 ' A' ' 6' ' ' ILE . 1.8 pp -144.22 111.61 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.601 -0.687 . . . . 0.0 109.595 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -113.08 96.34 5.88 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.542 -0.724 . . . . 0.0 109.449 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 61.51 63.29 1.2 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.528 -0.732 . . . . 0.0 109.492 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -64.68 -30.86 71.89 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.444 -0.785 . . . . 0.0 109.325 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.9 -53.18 58.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.582 -0.699 . . . . 0.0 109.303 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 38' ' ' VAL . 32.4 t -61.01 -30.9 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.555 -0.716 . . . . 0.0 109.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 6.7 tp -58.98 -35.69 73.63 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.703 -0.623 . . . . 0.0 109.64 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -85.82 -16.6 38.2 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.521 -0.737 . . . . 0.0 110.465 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.656 ' HE2' HG13 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -67.3 -48.71 66.82 Favored 'General case' 0 C--N 1.308 -1.238 0 O-C-N 121.363 -0.836 . . . . 0.0 110.846 -179.178 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.566 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 92.6 m95 -102.41 -30.86 10.77 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.557 -1.339 . . . . 0.0 112.315 -178.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.41 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.6 mm-40 -71.34 -22.43 61.91 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 110.157 -177.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' CD1' ' A' ' 19' ' ' LEU . 94.0 mt-30 -80.27 -32.37 38.23 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.332 -0.855 . . . . 0.0 109.098 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.77 63.97 0.43 Allowed Glycine 0 N--CA 1.494 2.55 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.918 ' HB2' HG23 ' A' ' 24' ' ' ILE . 2.5 mp -122.47 -178.94 4.04 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.41 -1.053 . . . . 0.0 109.98 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.462 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -152.09 118.62 0.91 Allowed Glycine 0 N--CA 1.496 2.691 0 C-N-CA 119.974 -1.107 . . . . 0.0 111.515 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.678 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 32.99 -86.02 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.488 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 179.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 t -67.1 -52.13 45.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.263 -0.898 . . . . 0.0 110.577 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.846 ' CD2' HD23 ' A' ' 19' ' ' LEU . 82.8 t60 -58.87 -38.92 79.87 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.534 -0.729 . . . . 0.0 110.04 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.918 HG23 ' HB2' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -57.29 -35.3 48.43 Favored 'Isoleucine or valine' 0 N--CA 1.525 3.314 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 179.582 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.545 ' HA ' HD12 ' A' ' 30' ' ' ILE . 23.1 t -68.53 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.114 0.483 . . . . 0.0 109.848 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.74 -27.61 65.1 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.378 -0.826 . . . . 0.0 110.089 -179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.55 ' OG1' HD21 ' A' ' 19' ' ' LEU . 46.1 m -90.43 -67.22 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.466 -0.771 . . . . 0.0 111.162 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.5 mmt -92.82 23.87 3.93 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.209 -0.932 . . . . 0.0 111.597 -178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 36.48 84.37 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 177.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.925 HD13 HG21 ' A' ' 35' ' ' VAL . 0.8 OUTLIER -160.25 145.7 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.366 -0.833 . . . . 0.0 109.585 179.194 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.636 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -60.3 149.31 33.88 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.208 -0.933 . . . . 0.0 109.102 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.584 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 35.0 ptt180 -74.26 -41.15 61.73 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.244 -0.91 . . . . 0.0 111.948 -178.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.45 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 2.4 t -67.14 -44.1 80.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 108.544 -179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 84.9 m -59.4 -40.08 85.45 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.8 1.286 . . . . 0.0 107.992 178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.925 HG21 HD13 ' A' ' 30' ' ' ILE . 5.8 t -60.09 -37.26 72.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.648 179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.598 ' HA ' HD12 ' A' ' 39' ' ' ILE . 4.7 m-85 -67.64 -23.27 65.32 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 119.735 -0.786 . . . . 0.0 110.997 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -62.96 -35.35 79.85 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.701 HG11 HG11 ' A' ' 11' ' ' VAL . 58.7 t -69.87 -60.57 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.664 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.634 HD12 ' O ' ' A' ' 35' ' ' VAL . 2.1 mp -54.99 -31.56 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.443 0 CA-C-O 121.718 0.77 . . . . 0.0 109.939 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -67.07 -42.64 84.35 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -100.67 25.22 8.07 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.731 -0.605 . . . . 0.0 109.701 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.2 t -80.26 -37.64 32.49 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.471 -0.768 . . . . 0.0 109.577 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 117.98 -1.009 . . . . 0.0 109.63 -179.969 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -98.9 38.52 1.37 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.517 -0.99 . . . . 0.0 109.486 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -98.21 149.61 22.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.588 -0.695 . . . . 0.0 109.523 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.16 51.14 0.93 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.553 -0.717 . . . . 0.0 109.382 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.66 30.5 3.26 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.497 -0.752 . . . . 0.0 109.557 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.613 ' O ' HD12 ' A' ' 6' ' ' ILE . 1.9 pp -149.87 114.42 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.504 -0.747 . . . . 0.0 109.471 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.637 ' OD1' ' HB2' ' A' ' 10' ' ' ALA . 1.8 t0 -113.6 50.34 0.92 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.587 -0.696 . . . . 0.0 109.52 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -61.97 -29.9 70.56 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.447 -0.783 . . . . 0.0 109.748 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -70.23 -29.11 65.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.536 -0.727 . . . . 0.0 109.811 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.637 ' HB2' ' OD1' ' A' ' 7' ' ' ASP . . . -59.02 -46.57 87.88 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.418 -0.801 . . . . 0.0 109.833 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.552 HG12 ' HD1' ' A' ' 15' ' ' TRP . 38.3 t -62.48 -48.53 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 109.052 179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -63.56 -15.9 59.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.72 -0.612 . . . . 0.0 110.503 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -77.46 -43.52 32.09 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.924 -1.11 . . . . 0.0 110.409 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.949 ' CB ' HG23 ' A' ' 24' ' ' ILE . 27.0 mmt -77.99 -48.75 15.51 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 121.341 -0.85 . . . . 0.0 111.093 -178.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.843 ' NE1' HD11 ' A' ' 39' ' ' ILE . 83.5 m95 -63.69 -47.4 81.31 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.821 -1.175 . . . . 0.0 111.491 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -67.81 -36.55 80.61 Favored 'General case' 0 C--N 1.299 -1.627 0 O-C-N 121.88 -0.513 . . . . 0.0 110.854 -177.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -63.05 -24.0 67.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.278 -0.889 . . . . 0.0 109.944 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 107.47 62.45 0.57 Allowed Glycine 0 N--CA 1.496 2.662 0 N-CA-C 109.233 -1.547 . . . . 0.0 109.233 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.915 HD23 ' CD2' ' A' ' 23' ' ' HIS . 2.1 mp -130.72 -172.98 2.95 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.648 -0.913 . . . . 0.0 110.063 -178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -140.93 129.4 4.08 Favored Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.885 -1.686 . . . . 0.0 108.885 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.793 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . -15.27 -44.86 0.0 OUTLIER 'General case' 0 N--CA 1.524 3.272 0 C-N-CA 124.837 1.255 . . . . 0.0 114.021 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 20' ' ' GLY . 3.3 m -48.84 -74.03 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.282 -0.886 . . . . 0.0 109.81 179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.915 ' CD2' HD23 ' A' ' 19' ' ' LEU . 1.3 p-80 -85.98 2.64 45.47 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 121.271 -0.893 . . . . 0.0 111.332 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.949 HG23 ' CB ' ' A' ' 14' ' ' MET . 20.6 mt -75.3 -37.29 38.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.195 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 177.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.404 ' HA ' HG13 ' A' ' 30' ' ' ILE . 0.8 OUTLIER -91.6 -26.95 18.46 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.7 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -42.44 82.83 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.371 -0.831 . . . . 0.0 109.007 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.3 m -79.39 -45.34 19.7 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.57 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.33 110.46 22.22 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 179.179 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 12.3 m120 -37.96 89.39 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.829 HD12 HG22 ' A' ' 35' ' ' VAL . 1.1 pt -179.46 176.2 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.36 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.65 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -98.8 162.66 12.98 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.307 -0.87 . . . . 0.0 109.13 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.793 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 28.4 ptt180 -77.5 -38.3 49.29 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.2 -0.937 . . . . 0.0 110.607 -179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.437 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 0.8 OUTLIER -73.7 -39.45 64.34 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.1 m -61.07 -39.69 90.86 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 122.596 1.189 . . . . 0.0 107.829 178.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.829 HG22 HD12 ' A' ' 30' ' ' ILE . 14.0 t -61.01 -41.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.47 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 5.1 m-85 -68.4 -19.76 64.63 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.845 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -59.76 -37.37 78.84 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 175.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.38 -56.65 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.325 178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.843 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.5 mm -52.21 -31.47 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 CA-C-O 121.796 0.808 . . . . 0.0 110.581 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -74.07 -41.82 61.13 Favored 'General case' 0 C--N 1.287 -2.134 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -96.7 23.51 6.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.795 -0.566 . . . . 0.0 109.851 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 74.0 p -85.94 -31.36 22.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.435 -0.791 . . . . 0.0 109.451 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.501 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.52 -163.98 0.9 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.586 -0.95 . . . . 0.0 109.325 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -94.1 46.47 1.17 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.555 -0.716 . . . . 0.0 109.419 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 30.7 mtt180 -107.87 156.84 18.72 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.46 -0.775 . . . . 0.0 109.494 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.81 121.57 45.53 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.611 -0.68 . . . . 0.0 109.492 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.7 mm -121.97 84.02 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.554 -0.717 . . . . 0.0 109.453 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -106.12 171.31 7.42 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.56 -0.713 . . . . 0.0 109.463 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 mtt180 73.29 -80.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.8 -0.563 . . . . 0.0 110.256 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.92 -23.8 61.7 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.955 -1.091 . . . . 0.0 110.154 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.19 -47.5 76.72 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.8 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.767 HG11 ' CG1' ' A' ' 38' ' ' VAL . 74.7 t -64.52 -57.89 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 7.2 tt -53.4 -23.23 9.2 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.827 -0.546 . . . . 0.0 110.952 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -72.59 -40.01 66.92 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.395 -0.816 . . . . 0.0 110.396 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.823 ' CB ' HG23 ' A' ' 24' ' ' ILE . 11.4 mmt -67.72 -45.43 75.05 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.433 -0.792 . . . . 0.0 111.682 -178.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.917 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 62.9 m95 -70.61 -27.57 64.18 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.121 -0.987 . . . . 0.0 110.577 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -81.83 -18.66 43.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.483 -0.761 . . . . 0.0 110.432 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.537 ' HB2' HD22 ' A' ' 19' ' ' LEU . 4.2 mm100 -85.09 -31.43 23.37 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.215 -0.928 . . . . 0.0 109.681 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.24 -0.61 7.05 Favored Glycine 0 N--CA 1.495 2.595 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.625 HD23 ' HA ' ' A' ' 14' ' ' MET . 0.4 OUTLIER -62.42 -176.48 0.11 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.111 -1.229 . . . . 0.0 109.906 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -155.24 121.5 1.11 Allowed Glycine 0 N--CA 1.494 2.526 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.262 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.822 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 20.57 -80.46 0.0 OUTLIER 'General case' 0 N--CA 1.516 2.836 0 N-CA-C 114.02 1.119 . . . . 0.0 114.02 178.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.412 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.3 t -44.45 -59.91 2.2 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.535 -0.728 . . . . 0.0 111.089 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.489 ' CD2' ' HG ' ' A' ' 19' ' ' LEU . 5.9 t60 -67.38 -40.07 85.69 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.451 -0.781 . . . . 0.0 109.251 179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.823 HG23 ' CB ' ' A' ' 14' ' ' MET . 62.8 mt -69.12 -7.91 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.42 0 O-C-N 121.517 -0.739 . . . . 0.0 111.045 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.411 ' HB3' ' N ' ' A' ' 31' ' ' ALA . 10.1 m -113.92 -71.78 0.73 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.477 -0.764 . . . . 0.0 111.266 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.95 -38.72 73.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.851 -1.155 . . . . 0.0 110.29 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.618 HG22 ' CE ' ' A' ' 28' ' ' MET . 13.0 m -93.16 -27.17 17.06 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.963 -0.695 . . . . 0.0 111.969 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.618 ' CE ' HG22 ' A' ' 27' ' ' THR . 13.8 mmt -118.08 -42.71 2.79 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.058 -1.026 . . . . 0.0 112.049 -177.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.771 ' O ' HG23 ' A' ' 30' ' ' ILE . 7.6 m-80 -119.52 -93.5 0.52 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.887 -1.133 . . . . 0.0 111.473 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.771 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 175.2 114.43 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 O-C-N 121.135 -0.978 . . . . 0.0 109.438 -179.33 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.411 ' N ' ' HB3' ' A' ' 25' ' ' SER . . . 61.58 143.63 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.395 -0.816 . . . . 0.0 110.042 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.822 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -82.61 -45.85 14.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.067 -1.021 . . . . 0.0 111.873 -178.441 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.423 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 59.4 p -62.41 -42.42 99.43 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.126 -0.983 . . . . 0.0 108.526 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 72.2 m -63.43 -49.68 72.79 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 39' ' ' ILE . 2.7 t -56.92 -22.08 15.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.368 179.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.872 ' CD1' HD12 ' A' ' 39' ' ' ILE . 1.1 m-85 -75.79 -36.33 59.81 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.897 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -55.39 -36.34 66.29 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.767 ' CG1' HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -64.38 -50.23 77.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.824 179.236 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.917 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 5.0 mt -57.4 -38.36 62.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-O 121.537 0.684 . . . . 0.0 109.946 -177.058 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -62.49 -39.15 92.55 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -63.35 -29.55 70.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.823 -0.548 . . . . 0.0 109.642 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.1 m -118.37 27.46 8.94 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.563 -0.711 . . . . 0.0 109.797 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.889 0 CA-C-O 117.985 -1.007 . . . . 0.0 109.815 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -92.34 127.36 37.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.639 -0.918 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.1 mttt -120.76 80.13 1.59 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.589 -0.695 . . . . 0.0 109.398 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.83 92.08 2.49 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.59 -0.694 . . . . 0.0 109.392 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 156.81 17.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.568 -0.707 . . . . 0.0 109.551 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.638 HG22 ' H ' ' A' ' 7' ' ' ASP . 7.5 mt 59.89 175.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.576 -0.702 . . . . 0.0 109.137 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.751 ' O ' HG23 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -125.27 46.78 2.29 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.416 -0.803 . . . . 0.0 109.62 -179.609 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -70.42 -77.62 0.08 Allowed 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.569 -0.707 . . . . 0.0 109.676 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -63.43 -24.8 67.99 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.496 -0.752 . . . . 0.0 109.86 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.592 ' HB3' ' OD1' ' A' ' 7' ' ' ASP . . . -62.41 -44.82 95.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.43 -0.793 . . . . 0.0 109.827 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 38' ' ' VAL . 87.0 t -62.8 -50.27 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.341 -0.849 . . . . 0.0 108.998 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.431 ' O ' HD23 ' A' ' 12' ' ' LEU . 3.6 tt -56.36 -29.42 61.37 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.896 -0.502 . . . . 0.0 110.678 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -70.34 -33.83 71.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.455 -0.778 . . . . 0.0 110.098 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.641 ' HB3' HG22 ' A' ' 24' ' ' ILE . 30.7 mmt -65.3 -47.98 74.71 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.561 -0.712 . . . . 0.0 110.007 -179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 1.007 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 78.9 m95 -62.42 -33.2 74.32 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.11 -0.994 . . . . 0.0 110.177 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -63.35 -22.19 66.73 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.684 -0.635 . . . . 0.0 110.742 -178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.61 22.54 4.62 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.357 -0.839 . . . . 0.0 110.35 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 70.06 54.85 10.27 Favored Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.809 ' HB3' HG23 ' A' ' 24' ' ' ILE . 4.8 mp -110.01 162.97 14.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.551 -0.97 . . . . 0.0 110.455 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.488 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -154.35 119.17 0.91 Allowed Glycine 0 N--CA 1.499 2.87 0 C-N-CA 120.031 -1.08 . . . . 0.0 111.721 -179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.669 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 31.39 -85.53 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.465 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 179.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 18.0 m -66.1 -53.69 34.92 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.315 -0.866 . . . . 0.0 110.696 -178.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -58.28 -32.78 68.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.587 -0.696 . . . . 0.0 110.169 -179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.809 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -67.03 -36.73 77.8 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.892 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 179.038 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.5 t -59.81 -28.46 67.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.505 -0.747 . . . . 0.0 109.429 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.59 -51.84 60.67 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.6 m -75.12 -71.39 0.36 Allowed 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 178.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.619 ' SD ' HD11 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -78.14 96.18 5.11 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 177.681 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.535 ' C ' HD13 ' A' ' 30' ' ' ILE . 5.4 m-20 -59.92 83.83 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.619 HD11 ' SD ' ' A' ' 28' ' ' MET . 0.0 OUTLIER -156.34 174.44 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 121.251 -0.905 . . . . 0.0 109.484 177.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.867 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -74.71 141.66 44.47 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.451 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 3.2 ppt_? -70.56 -38.76 74.18 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.076 -178.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 p -64.49 -40.78 96.3 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.995 -1.065 . . . . 0.0 108.814 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.2 m -64.17 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.867 HG23 ' O ' ' A' ' 31' ' ' ALA . 71.3 t -59.88 -29.99 44.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.882 ' CD1' HD12 ' A' ' 39' ' ' ILE . 2.9 m-85 -72.12 -31.42 66.01 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.976 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.04 -36.79 68.42 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-O 122.383 1.087 . . . . 0.0 108.206 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.967 HG11 HG11 ' A' ' 11' ' ' VAL . 0.9 OUTLIER -68.6 -55.49 15.78 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-N 115.23 -0.895 . . . . 0.0 112.073 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 1.007 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 1.1 mt -54.65 -45.01 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 121.93 0.871 . . . . 0.0 109.478 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -60.56 -39.1 86.72 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -64.13 -28.9 70.09 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 120.274 -0.571 . . . . 0.0 109.626 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.9 t -69.96 -45.92 66.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.539 -0.725 . . . . 0.0 109.502 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 38.9 t-20 . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.969 -1.015 . . . . 0.0 109.467 -179.963 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -79.43 85.77 5.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.59 -0.947 . . . . 0.0 109.424 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -102.81 40.54 1.36 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.541 -0.725 . . . . 0.0 109.534 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 tmm_? -96.75 40.83 1.12 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.565 -0.709 . . . . 0.0 109.346 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -87.75 -31.1 19.83 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.571 -0.706 . . . . 0.0 109.422 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.486 HG22 ' N ' ' A' ' 7' ' ' ASP . 44.0 mm -68.95 162.7 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.568 -0.707 . . . . 0.0 109.238 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.486 ' N ' HG22 ' A' ' 6' ' ' ILE . 12.3 t70 -93.3 47.87 1.28 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.525 -0.734 . . . . 0.0 109.571 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.3 mtt180 -87.11 -59.69 2.19 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.582 -0.699 . . . . 0.0 109.485 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -64.01 -24.56 67.76 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.611 -0.681 . . . . 0.0 109.92 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.95 -52.11 65.37 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.359 -0.838 . . . . 0.0 109.71 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 38' ' ' VAL . 22.2 t -60.61 -34.83 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.82 0 O-C-N 121.552 -0.718 . . . . 0.0 109.6 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.842 HD23 ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -61.2 -39.06 88.8 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.783 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -66.98 -26.31 66.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.419 -0.801 . . . . 0.0 109.981 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.872 ' SD ' HD11 ' A' ' 30' ' ' ILE . 3.2 mtm -67.4 -67.08 0.48 Allowed 'General case' 0 C--N 1.306 -1.288 0 O-C-N 121.345 -0.847 . . . . 0.0 111.146 -179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.586 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 90.0 m95 -66.23 -40.03 89.99 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.087 -1.008 . . . . 0.0 112.081 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.842 ' HG3' HD23 ' A' ' 12' ' ' LEU . 14.8 mm100 -59.29 -20.83 57.58 Favored 'General case' 0 C--N 1.298 -1.667 0 O-C-N 121.662 -0.649 . . . . 0.0 110.815 -177.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -89.47 -27.33 20.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.324 -0.86 . . . . 0.0 109.75 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.72 68.84 0.55 Allowed Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.231 -1.548 . . . . 0.0 109.231 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.906 ' CB ' HG23 ' A' ' 24' ' ' ILE . 0.0 OUTLIER -120.9 162.61 19.55 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.626 -0.926 . . . . 0.0 109.995 -178.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.5 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -136.22 118.92 1.9 Allowed Glycine 0 N--CA 1.5 2.937 0 C-N-CA 120.264 -0.969 . . . . 0.0 111.586 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.715 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 31.22 -85.36 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 179.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.7 t -67.68 -53.11 30.32 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.3 -0.875 . . . . 0.0 110.55 -178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.432 ' CD2' HD12 ' A' ' 19' ' ' LEU . 7.9 t60 -59.06 -26.49 64.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.595 -0.691 . . . . 0.0 110.551 -179.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.906 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -69.92 -36.44 69.16 Favored 'Isoleucine or valine' 0 N--CA 1.517 2.889 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 179.402 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.4 t -64.41 -40.9 96.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.718 -0.614 . . . . 0.0 110.105 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -60.72 -34.4 74.35 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.475 -0.765 . . . . 0.0 109.926 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 18.4 m -71.25 -58.49 3.49 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.517 -0.739 . . . . 0.0 109.947 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.42 ' HB2' ' CE ' ' A' ' 14' ' ' MET . 23.9 mmt -104.61 -140.83 0.36 Allowed 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.718 ' O ' HG23 ' A' ' 30' ' ' ILE . 1.4 t-20 -137.48 88.21 2.32 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.332 -1.48 . . . . 0.0 111.82 -178.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.891 HD13 HG22 ' A' ' 35' ' ' VAL . 1.1 pp -168.29 153.49 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.28 0 O-C-N 121.234 -0.916 . . . . 0.0 110.39 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.821 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -71.69 167.04 20.69 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.715 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 7.1 ppt_? -64.26 -41.47 96.94 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.236 -0.915 . . . . 0.0 111.529 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.04 -30.22 58.36 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.163 -0.96 . . . . 0.0 108.953 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 93.3 m -63.93 -34.66 78.47 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.891 HG22 HD13 ' A' ' 30' ' ' ILE . 2.5 t -63.58 -45.03 98.74 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.31 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.577 ' HA ' HD12 ' A' ' 39' ' ' ILE . 14.4 m-85 -62.94 -16.71 60.27 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 120.156 -0.618 . . . . 0.0 111.498 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -67.4 -39.1 85.56 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 175.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.92 HG11 HG11 ' A' ' 11' ' ' VAL . 66.3 t -71.49 -60.91 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-N 115.096 -0.956 . . . . 0.0 112.034 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.803 HD11 HG12 ' A' ' 35' ' ' VAL . 1.8 mp -55.67 -32.98 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 CA-C-O 121.758 0.79 . . . . 0.0 109.63 -176.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -65.54 -41.68 92.8 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.19 -34.08 76.86 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.714 -0.616 . . . . 0.0 109.476 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m 59.64 37.18 22.55 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.54 -0.725 . . . . 0.0 109.793 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.2 t30 . . . . . 0 N--CA 1.496 1.851 0 CA-C-O 117.997 -1.001 . . . . 0.0 109.711 179.988 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.324 0 N-CA-C 109.471 -1.451 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -65.23 157.55 28.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.575 -0.956 . . . . 0.0 109.41 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -102.21 88.91 3.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.626 -0.672 . . . . 0.0 109.566 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -65.18 -34.88 79.44 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.569 -0.707 . . . . 0.0 109.358 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -75.78 -169.68 1.13 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.626 -0.671 . . . . 0.0 109.326 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 37.5 mm 61.24 105.8 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.484 -0.76 . . . . 0.0 109.551 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.41 -171.68 2.54 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.621 -0.674 . . . . 0.0 109.524 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.417 ' O ' HD12 ' A' ' 12' ' ' LEU . 31.2 mmt180 59.87 19.43 8.36 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.604 -0.685 . . . . 0.0 110.232 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.42 -33.93 73.71 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.284 -0.885 . . . . 0.0 109.674 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.11 72.07 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.558 -0.714 . . . . 0.0 109.773 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.61 HG12 ' HD1' ' A' ' 15' ' ' TRP . 10.6 t -76.94 -32.34 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 8' ' ' ARG . 0.9 OUTLIER -63.04 -22.74 67.07 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.469 -0.77 . . . . 0.0 109.427 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -83.5 -45.83 13.15 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.102 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.701 ' O ' HG23 ' A' ' 24' ' ' ILE . 24.0 ptp -71.03 -3.82 21.68 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.508 -0.745 . . . . 0.0 111.486 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.61 ' HD1' HG12 ' A' ' 11' ' ' VAL . 33.5 m95 -120.57 -42.46 2.54 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.463 -1.398 . . . . 0.0 111.22 -178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -78.7 0.67 25.75 Favored 'General case' 0 C--N 1.292 -1.917 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.382 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -103.77 22.71 13.98 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.097 -1.002 . . . . 0.0 110.041 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.504 ' O ' HD12 ' A' ' 19' ' ' LEU . . . 76.59 63.55 2.32 Favored Glycine 0 N--CA 1.496 2.668 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.504 HD12 ' O ' ' A' ' 18' ' ' GLY . 0.8 OUTLIER -127.41 160.3 31.85 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.742 -0.858 . . . . 0.0 110.452 -178.679 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.439 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -161.5 125.23 1.41 Allowed Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.01 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.5 ' N ' HG13 ' A' ' 24' ' ' ILE . . . 30.1 -84.41 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.49 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 179.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' GLY . 1.1 t -63.92 -52.03 61.7 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.267 -0.896 . . . . 0.0 111.161 -177.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.465 ' CD2' ' CD1' ' A' ' 19' ' ' LEU . 7.3 t60 -61.49 -30.72 70.79 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.446 -0.783 . . . . 0.0 109.834 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.701 HG23 ' O ' ' A' ' 14' ' ' MET . 0.2 OUTLIER -77.26 -24.36 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.942 0 N-CA-C 107.248 -1.39 . . . . 0.0 107.248 178.778 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.9 t -58.52 -48.32 81.23 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.966 -1.083 . . . . 0.0 110.319 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.429 ' NZ ' ' HA ' ' A' ' 23' ' ' HIS . 0.1 OUTLIER -73.9 -36.72 64.78 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.314 -0.954 . . . . 0.0 110.531 -179.239 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.0 m -62.12 -69.56 0.24 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.35 -0.843 . . . . 0.0 109.759 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.439 ' HE1' HG22 ' A' ' 35' ' ' VAL . 1.5 ptt? -80.07 -134.73 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.467 ' O ' HG23 ' A' ' 30' ' ' ILE . 36.2 m-20 -157.69 45.31 0.35 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.368 -1.458 . . . . 0.0 113.1 -178.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.467 HG23 ' O ' ' A' ' 29' ' ' ASN . 14.3 pt -154.25 166.6 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.958 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.426 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -57.21 162.48 2.64 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.684 -0.635 . . . . 0.0 110.404 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -72.55 -33.88 67.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.757 -0.589 . . . . 0.0 111.645 -178.825 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.476 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 12.3 p -74.78 -35.54 62.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.022 -1.048 . . . . 0.0 108.775 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 73.7 m -61.26 -33.22 73.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.473 ' C ' HD12 ' A' ' 39' ' ' ILE . 0.5 OUTLIER -65.86 -40.89 88.84 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 39' ' ' ILE . 12.3 m-85 -67.03 -13.77 62.24 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 119.421 -0.911 . . . . 0.0 110.981 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -69.05 -40.23 78.67 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.16 -1.792 . . . . 0.0 106.16 174.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.48 HG11 HG21 ' A' ' 11' ' ' VAL . 2.3 t -77.87 -56.06 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.282 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 36' ' ' TYR . 4.2 mt -54.17 -34.12 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.345 0 O-C-N 121.407 -0.808 . . . . 0.0 109.316 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.33 -40.96 73.84 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -60.98 -30.29 70.18 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.703 -0.623 . . . . 0.0 109.795 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t 62.18 -86.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.93 -0.482 . . . . 0.0 109.827 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.496 1.831 0 CA-C-O 118.015 -0.993 . . . . 0.0 109.773 -179.938 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -69.21 103.79 2.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.575 -0.956 . . . . 0.0 109.488 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.96 113.92 4.77 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.672 -0.643 . . . . 0.0 109.479 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -57.17 10.39 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.553 -0.717 . . . . 0.0 109.471 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.82 158.68 24.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.605 -0.685 . . . . 0.0 109.407 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.638 ' O ' HD12 ' A' ' 6' ' ' ILE . 2.4 pp -141.99 125.45 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.606 -0.684 . . . . 0.0 109.457 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -110.73 168.81 9.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.561 -0.712 . . . . 0.0 109.504 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.726 ' NH2' HD12 ' A' ' 12' ' ' LEU . 7.9 ptt180 41.48 49.29 3.53 Favored 'General case' 0 N--CA 1.507 2.394 0 CA-C-O 121.229 0.537 . . . . 0.0 111.772 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.69 -28.67 61.86 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.336 -0.852 . . . . 0.0 109.564 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.06 -54.84 5.61 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.546 -0.721 . . . . 0.0 110.029 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 38' ' ' VAL . 19.0 t -58.78 -40.19 79.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.288 -0.882 . . . . 0.0 109.176 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.726 HD12 ' NH2' ' A' ' 8' ' ' ARG . 5.5 tt -59.2 -39.07 81.48 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -57.44 -33.85 68.35 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.446 -0.784 . . . . 0.0 109.079 179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.902 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.3 mmt -62.59 -45.92 90.65 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.827 -0.546 . . . . 0.0 109.655 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.979 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 32.8 m95 -79.54 -0.27 32.73 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.171 -0.955 . . . . 0.0 111.079 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.58 ' HG3' HD23 ' A' ' 12' ' ' LEU . 7.9 mm100 -100.33 -21.5 15.42 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.962 -1.086 . . . . 0.0 111.321 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.431 ' HB2' HD11 ' A' ' 19' ' ' LEU . 94.4 mm-40 -95.62 10.61 36.15 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.133 -0.98 . . . . 0.0 111.362 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.564 ' C ' HD12 ' A' ' 19' ' ' LEU . . . 84.24 65.58 1.52 Allowed Glycine 0 N--CA 1.496 2.642 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 179.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.851 HD13 ' O ' ' A' ' 14' ' ' MET . 7.4 mp -124.18 -172.59 2.58 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.668 -0.901 . . . . 0.0 109.309 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -164.62 120.87 0.97 Allowed Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.002 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.562 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 17.38 -72.45 0.0 OUTLIER 'General case' 0 N--CA 1.522 3.163 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 20' ' ' GLY . 41.6 m -50.61 -59.98 3.5 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.118 -0.989 . . . . 0.0 110.361 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.69 ' CD2' HD23 ' A' ' 19' ' ' LEU . 5.9 t60 -65.65 -38.42 89.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.392 -0.818 . . . . 0.0 109.341 179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.902 HG23 ' HB3' ' A' ' 14' ' ' MET . 38.6 mt -72.96 -7.23 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.609 -0.682 . . . . 0.0 110.36 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.454 ' OG ' HG21 ' A' ' 35' ' ' VAL . 1.0 OUTLIER -87.21 -68.62 0.74 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.545 -0.722 . . . . 0.0 110.054 -178.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.758 ' HA ' HG22 ' A' ' 30' ' ' ILE . 0.1 OUTLIER -55.5 -26.17 41.23 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.623 -0.673 . . . . 0.0 110.685 -179.353 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.621 HG22 ' O ' ' A' ' 23' ' ' HIS . 12.8 t -85.67 -36.57 20.19 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.495 -0.753 . . . . 0.0 109.942 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.733 ' HG2' HG22 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -141.17 112.89 7.66 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -178.549 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.781 ' O ' HG22 ' A' ' 35' ' ' VAL . 4.3 t-20 40.35 90.08 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.707 -0.621 . . . . 0.0 111.862 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.758 HG22 ' HA ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -58.02 -162.87 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -177.679 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.971 ' O ' HG23 ' A' ' 35' ' ' VAL . . . 63.38 105.47 0.03 OUTLIER 'General case' 0 C--O 1.193 -1.876 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.436 ' CD ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 mtm180 -57.62 -52.83 63.83 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.686 -0.634 . . . . 0.0 111.66 -176.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.2 p -57.78 -40.98 81.11 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.112 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.603 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 88.3 m -67.57 -31.75 72.03 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.952 0.882 . . . . 0.0 108.938 178.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.971 HG23 ' O ' ' A' ' 31' ' ' ALA . 89.1 t -66.69 -31.19 52.4 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.89 ' CD1' HD12 ' A' ' 39' ' ' ILE . 16.2 m-85 -76.25 -23.02 54.46 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.368 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -37.85 84.12 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 175.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 1.035 HG11 HG11 ' A' ' 11' ' ' VAL . 1.3 t -67.94 -52.72 36.35 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.344 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.979 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 4.5 mt -58.43 -36.65 59.84 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 CA-C-O 121.819 0.819 . . . . 0.0 110.052 -176.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -66.05 -36.98 84.71 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -57.15 -21.31 31.8 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.723 -0.611 . . . . 0.0 110.117 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.4 t -57.05 -53.28 59.85 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.349 -0.845 . . . . 0.0 109.949 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.8 p30 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.488 179.968 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -95.78 108.03 20.32 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.618 -0.931 . . . . 0.0 109.517 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.6 mmtp -71.35 162.36 29.56 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.607 -0.683 . . . . 0.0 109.454 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -90.54 -172.28 3.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.581 -0.7 . . . . 0.0 109.525 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.4 mmmt -101.88 169.84 8.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.557 -0.714 . . . . 0.0 109.544 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.613 ' O ' HD12 ' A' ' 6' ' ' ILE . 2.6 pp -143.14 133.78 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.581 -0.7 . . . . 0.0 109.496 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -103.81 103.12 12.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.609 -0.682 . . . . 0.0 109.512 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 -62.13 -37.28 84.55 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.602 -0.686 . . . . 0.0 109.85 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.06 -26.3 66.04 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.519 -0.738 . . . . 0.0 110.163 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.739 ' HB1' ' SD ' ' A' ' 28' ' ' MET . . . -62.79 -53.07 59.84 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.467 -0.771 . . . . 0.0 109.915 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.899 HG11 ' CG1' ' A' ' 38' ' ' VAL . 45.4 t -59.43 -34.6 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.287 -0.883 . . . . 0.0 109.387 -179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.413 ' O ' ' HB2' ' A' ' 16' ' ' GLN . 16.1 mt -65.27 -33.48 76.07 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -66.56 -31.02 71.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.164 -0.96 . . . . 0.0 110.562 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.948 ' HB3' HG23 ' A' ' 24' ' ' ILE . 16.4 mtm -70.51 -61.04 1.92 Allowed 'General case' 0 C--N 1.307 -1.245 0 O-C-N 121.278 -0.889 . . . . 0.0 111.372 -178.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.572 ' CZ2' ' CD1' ' A' ' 39' ' ' ILE . 97.7 m95 -76.33 -42.01 46.49 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.295 -0.878 . . . . 0.0 112.963 -176.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 7.9 mm100 -63.25 -26.42 68.77 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.599 -0.688 . . . . 0.0 110.489 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.8 mm-40 -78.38 -24.41 46.37 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.311 -0.868 . . . . 0.0 109.807 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 105.12 63.13 0.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.944 HD22 ' CD2' ' A' ' 23' ' ' HIS . 8.4 mt -119.51 -173.63 2.56 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.616 -0.932 . . . . 0.0 110.831 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 22' ' ' SER . . . -145.45 116.51 0.91 Allowed Glycine 0 N--CA 1.498 2.832 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.469 -178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.705 ' N ' HD12 ' A' ' 24' ' ' ILE . . . 10.1 -65.35 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.3 1.592 . . . . 0.0 115.3 178.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.518 ' N ' ' O ' ' A' ' 20' ' ' GLY . 16.5 m -45.61 -57.44 4.18 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.07 -1.019 . . . . 0.0 110.826 -178.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.944 ' CD2' HD22 ' A' ' 19' ' ' LEU . 10.2 t60 -81.52 -31.0 33.0 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.392 -0.818 . . . . 0.0 109.365 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.948 HG23 ' HB3' ' A' ' 14' ' ' MET . 67.8 mt -61.82 -21.99 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.298 -0.876 . . . . 0.0 110.613 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.9 p -109.05 -54.45 2.53 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.307 -0.871 . . . . 0.0 110.596 -178.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -24.86 65.1 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.434 -0.791 . . . . 0.0 110.235 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.663 HG21 ' NE2' ' A' ' 23' ' ' HIS . 18.4 m -86.4 -57.01 3.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.453 -0.779 . . . . 0.0 109.828 -179.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.739 ' SD ' ' HB1' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -65.66 -101.97 0.0 OUTLIER 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 179.572 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.764 ' O ' HG23 ' A' ' 30' ' ' ILE . 25.7 t-20 -163.58 64.66 0.17 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.551 -1.343 . . . . 0.0 111.039 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.764 HG23 ' O ' ' A' ' 29' ' ' ASN . 0.7 OUTLIER -176.43 -175.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 O-C-N 121.084 -1.01 . . . . 0.0 110.075 179.471 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.936 ' O ' HG23 ' A' ' 35' ' ' VAL . . . -97.83 170.64 8.83 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.55 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -64.4 -46.67 82.26 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.114 -0.991 . . . . 0.0 111.703 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.415 ' N ' ' CD ' ' A' ' 32' ' ' ARG . 1.0 OUTLIER -67.88 -36.25 79.92 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.206 -0.934 . . . . 0.0 108.753 -179.605 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.6 m -61.06 -35.23 76.39 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.938 HG12 HD11 ' A' ' 39' ' ' ILE . 12.2 t -64.17 -34.22 67.46 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.309 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.643 ' HA ' HD12 ' A' ' 39' ' ' ILE . 13.4 m-85 -75.28 -15.36 60.52 Favored 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 119.615 -0.834 . . . . 0.0 111.397 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -67.28 -39.42 86.01 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.899 ' CG1' HG11 ' A' ' 11' ' ' VAL . 2.1 t -74.47 -55.01 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.237 179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.938 HD11 HG12 ' A' ' 35' ' ' VAL . 6.3 mt -56.03 -33.28 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.407 -0.808 . . . . 0.0 109.631 -177.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -68.17 -40.6 82.27 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -63.48 -28.1 69.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.79 -0.569 . . . . 0.0 109.586 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 t 61.05 32.62 19.79 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.441 -0.787 . . . . 0.0 109.584 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.454 -179.992 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.328 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.0 ttt180 -102.53 139.03 38.65 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.612 -0.934 . . . . 0.0 109.512 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.71 30.68 3.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.638 -0.664 . . . . 0.0 109.474 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 6.3 ttm180 -88.63 82.08 6.95 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.552 -0.718 . . . . 0.0 109.453 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.619 ' O ' HD13 ' A' ' 6' ' ' ILE . 4.4 tttt -102.68 71.28 1.17 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.585 -0.697 . . . . 0.0 109.381 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.619 HD13 ' O ' ' A' ' 5' ' ' LYS . 46.0 mm -132.39 65.63 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.507 -0.746 . . . . 0.0 109.517 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.24 44.92 0.99 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.446 -0.784 . . . . 0.0 109.28 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 173.62 75.64 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.83 -29.14 60.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.515 -0.74 . . . . 0.0 109.703 -179.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.15 -59.05 3.52 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.579 -0.701 . . . . 0.0 109.678 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.424 HG11 HG11 ' A' ' 38' ' ' VAL . 46.0 t -60.87 -38.4 79.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.564 -0.71 . . . . 0.0 109.626 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 12' ' ' LEU . 31.9 mt -70.98 -21.72 62.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.528 -0.732 . . . . 0.0 110.359 -179.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -71.74 -47.4 54.03 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.999 -1.063 . . . . 0.0 110.709 -179.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.746 ' SD ' HD13 ' A' ' 30' ' ' ILE . 12.7 ptp -73.32 -48.21 36.26 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 121.295 -0.878 . . . . 0.0 112.339 -177.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.752 ' NE1' HD11 ' A' ' 39' ' ' ILE . 75.3 m95 -65.57 -49.83 67.36 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.653 -1.279 . . . . 0.0 111.686 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 mm-40 -62.81 -25.8 68.43 Favored 'General case' 0 C--N 1.296 -1.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.901 -176.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -71.33 -29.57 65.16 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.315 -0.866 . . . . 0.0 109.114 178.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 123.26 50.84 0.21 Allowed Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.424 -1.47 . . . . 0.0 109.424 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HG23 ' A' ' 24' ' ' ILE . 1.7 mp -112.07 168.96 9.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.589 -0.948 . . . . 0.0 110.504 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.479 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -153.67 117.76 0.82 Allowed Glycine 0 N--CA 1.498 2.805 0 C-N-CA 119.979 -1.105 . . . . 0.0 111.851 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.661 ' HB1' ' HB2' ' A' ' 32' ' ' ARG . . . 34.94 -86.6 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 178.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.4 m -70.96 -51.65 24.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.174 -0.954 . . . . 0.0 110.236 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -57.39 -30.49 64.96 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.607 -0.683 . . . . 0.0 110.142 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.768 HG23 ' CB ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -65.43 -39.7 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.752 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 179.254 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.2 m -58.53 -32.42 68.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.703 -0.623 . . . . 0.0 109.84 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.8 -43.78 98.18 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.573 -0.704 . . . . 0.0 109.162 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.765 ' OG1' HD21 ' A' ' 19' ' ' LEU . 6.4 m -74.1 -66.58 0.7 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.547 -0.72 . . . . 0.0 109.414 179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' ILE . 3.4 mtm -117.14 109.97 17.59 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -45.35 102.53 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.706 -0.621 . . . . 0.0 112.063 -178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 1.046 HD12 HG21 ' A' ' 35' ' ' VAL . 35.7 pt -143.79 159.4 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.64 -0.663 . . . . 0.0 109.9 179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.749 ' HB3' ' HB ' ' A' ' 34' ' ' THR . . . -85.51 150.75 24.46 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 177.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.661 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 33.5 ptt180 -77.57 -46.48 22.11 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 120.914 -1.116 . . . . 0.0 111.893 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.459 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 47.2 p -71.49 -39.1 71.06 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.18 -0.95 . . . . 0.0 108.577 -179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.749 ' HB ' ' HB3' ' A' ' 31' ' ' ALA . 85.9 m -59.78 -46.84 87.95 Favored 'General case' 0 N--CA 1.495 1.813 0 CA-C-O 122.465 1.126 . . . . 0.0 108.804 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 1.046 HG21 HD12 ' A' ' 30' ' ' ILE . 27.3 t -60.08 -38.68 77.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.477 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.454 ' CE1' ' CH2' ' A' ' 15' ' ' TRP . 7.8 m-85 -69.01 -18.94 64.11 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.24 -178.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -61.28 -37.58 83.7 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 105.305 -2.109 . . . . 0.0 105.305 174.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.579 HG13 ' O ' ' A' ' 43' ' ' ASN . 2.2 t -77.05 -49.13 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 CA-C-N 114.609 -1.178 . . . . 0.0 111.818 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.752 HD11 ' NE1' ' A' ' 15' ' ' TRP . 7.6 mm -57.37 -37.61 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 120.884 -1.135 . . . . 0.0 110.086 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -68.82 -40.25 79.59 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.18 -14.41 62.26 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.838 -0.539 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.8 t 61.15 30.37 19.32 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.144 -0.973 . . . . 0.0 109.568 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.579 ' O ' HG13 ' A' ' 38' ' ' VAL . 2.3 m-20 . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.003 -0.998 . . . . 0.0 109.32 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.7 ptt180 -59.08 -27.32 65.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.452 -1.028 . . . . 0.0 110.077 -179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 116.25 3.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.526 -0.734 . . . . 0.0 110.008 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.12 -59.77 1.55 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.595 -0.691 . . . . 0.0 109.405 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -87.97 -172.03 3.66 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.595 -0.69 . . . . 0.0 109.464 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 46.3 mm -66.92 121.36 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.567 -0.708 . . . . 0.0 109.392 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -64.62 -170.34 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.582 -0.698 . . . . 0.0 109.125 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -96.37 27.45 3.76 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 121.484 -0.76 . . . . 0.0 109.99 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.431 ' HA ' HD12 ' A' ' 12' ' ' LEU . 21.5 t70 -70.33 -23.95 62.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.413 -0.804 . . . . 0.0 109.88 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.75 -54.31 37.33 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.385 -0.822 . . . . 0.0 109.768 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.607 ' CB ' HG11 ' A' ' 38' ' ' VAL . 56.7 t -58.07 -39.91 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.471 -0.768 . . . . 0.0 109.614 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 9' ' ' ASP . 95.6 mt -59.7 -37.75 79.71 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.68 -0.637 . . . . 0.0 109.777 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -65.87 -28.13 68.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.59 -0.693 . . . . 0.0 109.968 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.786 ' O ' HD22 ' A' ' 19' ' ' LEU . 25.4 mmt -63.97 -52.86 57.69 Favored 'General case' 0 C--N 1.309 -1.167 0 O-C-N 121.388 -0.82 . . . . 0.0 109.766 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.677 ' CZ2' HD11 ' A' ' 39' ' ' ILE . 86.5 m95 -63.93 -31.81 73.12 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.257 -0.902 . . . . 0.0 110.426 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -67.58 -18.87 65.15 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.804 -0.56 . . . . 0.0 110.713 -178.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -95.91 14.12 24.57 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.263 -0.898 . . . . 0.0 110.663 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.28 63.06 2.45 Favored Glycine 0 N--CA 1.495 2.611 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.801 ' HB3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -118.43 153.98 33.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.697 -0.884 . . . . 0.0 110.293 -179.224 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' N ' HG12 ' A' ' 24' ' ' ILE . . . -141.32 121.8 1.95 Allowed Glycine 0 N--CA 1.497 2.765 0 C-N-CA 120.349 -0.929 . . . . 0.0 110.961 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.656 ' H ' HD11 ' A' ' 24' ' ' ILE . . . 29.18 -84.78 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.549 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 5.3 m -64.12 -54.14 38.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.334 -0.854 . . . . 0.0 111.097 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.15 -32.79 71.37 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.801 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -64.36 -32.68 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.076 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 179.512 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -69.93 -27.71 64.99 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.661 -0.65 . . . . 0.0 109.496 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -47.61 83.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.283 -0.886 . . . . 0.0 109.031 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -74.16 -64.1 1.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.577 ' HB2' ' HG3' ' A' ' 14' ' ' MET . 0.0 OUTLIER -98.98 98.06 9.15 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.017 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -52.15 89.26 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.664 -0.647 . . . . 0.0 112.334 -177.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.47 HD12 ' O ' ' A' ' 28' ' ' MET . 0.1 OUTLIER -151.39 161.99 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 O-C-N 121.172 -0.955 . . . . 0.0 109.111 177.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.556 ' HB3' ' OG1' ' A' ' 34' ' ' THR . . . -72.41 158.83 35.02 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.341 -0.849 . . . . 0.0 109.429 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 33' ' ' SER . 0.0 OUTLIER -67.84 -42.33 81.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.55 -0.719 . . . . 0.0 111.213 -179.06 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.426 ' N ' ' HD2' ' A' ' 32' ' ' ARG . 3.3 p -72.46 -32.84 66.58 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.064 -1.022 . . . . 0.0 108.37 179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.556 ' OG1' ' HB3' ' A' ' 31' ' ' ALA . 89.6 m -62.23 -30.28 70.98 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.562 ' O ' HD12 ' A' ' 39' ' ' ILE . 0.9 OUTLIER -68.23 -40.54 82.88 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.664 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.716 ' HA ' HD12 ' A' ' 39' ' ' ILE . 20.3 m-85 -67.1 -11.98 58.7 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.762 -179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -74.58 -39.06 62.48 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.607 HG11 ' CB ' ' A' ' 11' ' ' VAL . 2.4 t -78.7 -54.38 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.147 -179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.716 HD12 ' HA ' ' A' ' 36' ' ' TYR . 2.1 mt -55.69 -38.13 49.42 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 O-C-N 121.168 -0.957 . . . . 0.0 108.906 -177.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -66.04 -40.84 91.33 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 178.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -61.76 -28.89 69.77 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.708 -0.62 . . . . 0.0 109.754 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 14.0 m -96.86 85.94 3.91 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.5 -0.75 . . . . 0.0 109.528 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 118.028 -0.986 . . . . 0.0 109.728 179.993 . . . . . . . . 0 0 . 1 stop_ save_