data_1a11_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 1a11 _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.211 0.529 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.36 -61.65 1.89 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -17.93 63.93 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.198 -0.938 . . . . 0.0 109.177 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.6 t -78.25 -33.68 49.53 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.293 -0.879 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 p -83.98 -18.06 38.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.337 -0.852 . . . . 0.0 109.322 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.68 -40.82 15.74 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.28 -0.888 . . . . 0.0 108.733 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.526 ' O ' ' CD2' ' A' ' 13' ' ' LEU . 1.4 pp -75.09 -30.75 23.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 O-C-N 121.392 -0.818 . . . . 0.0 109.46 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.5 OUTLIER -77.64 -46.97 20.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.158 -0.963 . . . . 0.0 108.915 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 t -61.33 -27.44 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.282 -0.886 . . . . 0.0 108.833 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.8 mt -60.7 -47.46 86.16 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 0.0 109.425 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.526 ' CD2' ' O ' ' A' ' 9' ' ' ILE . 2.5 mm? -71.15 -38.57 72.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.116 -0.99 . . . . 0.0 109.245 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -46.24 -50.74 15.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.392 -0.817 . . . . 0.0 109.603 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -69.13 -47.41 65.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.234 -0.916 . . . . 0.0 109.729 -179.782 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 15' ' ' GLN . . . -41.89 -52.57 4.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.395 -0.815 . . . . 0.0 110.127 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.405 HG11 ' O ' ' A' ' 17' ' ' VAL . 44.7 t -82.58 -23.68 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.131 -0.981 . . . . 0.0 109.919 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.471 ' HB2' ' HA ' ' A' ' 15' ' ' GLN . 2.4 t80 -53.4 -63.44 1.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.141 -0.974 . . . . 0.0 109.439 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 31.9 mt -61.23 -30.44 70.44 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 109.387 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.4 tp -61.13 -32.28 71.98 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.0 109.359 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.48 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 11.7 tp -80.62 -60.14 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.288 -0.882 . . . . 0.0 109.562 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.9 p -45.89 -34.36 3.8 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -0.863 . . . . 0.0 109.834 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.49 -47.76 31.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.0 109.702 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -83.45 10.99 7.58 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.235 -0.915 . . . . 0.0 109.596 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 4.0 mmt-85 . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.385 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.448 ' O ' ' OG1' ' A' ' 7' ' ' THR . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.273 0.559 . . . . 0.0 109.534 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.78 -53.25 10.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 0.0 109.514 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.418 ' SD ' HG22 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.67 -22.57 63.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.249 -0.907 . . . . 0.0 109.641 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.405 ' O ' HG13 ' A' ' 9' ' ' ILE . 47.0 t -80.43 -32.39 37.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.172 -0.955 . . . . 0.0 109.678 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.448 ' OG1' ' O ' ' A' ' 3' ' ' GLU . 1.6 p -82.18 -20.9 36.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.326 -0.859 . . . . 0.0 109.174 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.27 -40.93 17.4 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.423 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 2.5 pp -69.04 -32.78 55.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 73.5 m -67.85 -51.43 48.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.476 -0.765 . . . . 0.0 109.199 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.6 t -54.67 -34.36 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -0.918 . . . . 0.0 109.205 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.464 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 51.5 mt -61.53 -46.78 88.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 0.0 109.493 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -71.64 -21.31 61.84 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.203 -0.936 . . . . 0.0 109.095 -179.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -64.34 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.353 -0.842 . . . . 0.0 109.714 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -72.53 -22.96 60.94 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.163 -0.961 . . . . 0.0 109.704 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 12' ' ' LEU . . . -72.79 -72.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 50.7 t -55.58 -26.98 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 109.784 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 18' ' ' PHE . 2.1 t80 -63.28 -62.91 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.317 -0.864 . . . . 0.0 109.772 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' CB ' ' A' ' 23' ' ' SER . 83.7 mt -68.74 -16.84 63.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 110.015 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.434 ' C ' ' CD1' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -67.69 -51.92 43.93 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.052 -1.03 . . . . 0.0 109.24 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.4 tp -66.75 -46.55 75.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 0.0 109.246 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -14.71 63.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -0.927 . . . . 0.0 109.215 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.444 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -78.65 -67.82 0.71 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -78.09 -3.44 42.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.311 -0.868 . . . . 0.0 109.674 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.484 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.57 -65.67 0.7 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.301 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.8 ttt -61.84 -25.46 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.109 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -74.44 -30.95 62.1 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.256 -0.903 . . . . 0.0 109.23 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 11' ' ' VAL . 98.4 m -79.16 -21.42 46.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.333 -0.855 . . . . 0.0 108.914 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -80.44 -37.92 31.08 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.519 HG13 ' N ' ' A' ' 10' ' ' SER . 35.8 pt -67.23 -37.47 79.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.519 ' N ' HG13 ' A' ' 9' ' ' ILE . 10.1 m -67.37 -38.57 84.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.355 -0.841 . . . . 0.0 109.012 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 82.3 t -59.25 -39.23 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.319 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.77 -45.26 94.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.11 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.587 ' N ' ' CD2' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -66.34 -25.95 67.06 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.366 -0.833 . . . . 0.0 109.135 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 11' ' ' VAL . . . -50.2 -72.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.497 -0.752 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -58.62 -36.19 73.68 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.144 -0.972 . . . . 0.0 109.425 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.59 -38.18 20.02 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 109.654 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.441 ' O ' HD22 ' A' ' 21' ' ' LEU . 44.5 t -80.63 -36.05 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.951 . . . . 0.0 109.686 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.77 -56.83 7.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 23' ' ' SER . 2.9 pp -60.53 -29.45 69.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.08 -1.013 . . . . 0.0 108.697 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -30.29 71.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.547 -0.721 . . . . 0.0 109.19 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.467 ' N ' ' CD2' ' A' ' 21' ' ' LEU . 2.0 mt -71.28 -51.11 26.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.36 -0.838 . . . . 0.0 108.957 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.1 p -73.91 -5.27 40.11 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.37 -0.831 . . . . 0.0 109.564 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.436 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -84.97 -61.95 1.65 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.932 . . . . 0.0 109.727 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ARG . 3.5 tt0 -74.57 -34.87 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.146 -0.971 . . . . 0.0 109.2 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.51 ' CG ' ' O ' ' A' ' 25' ' ' ARG . 2.6 ttt180 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.684 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.3 0.571 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -46.12 81.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.261 -0.899 . . . . 0.0 109.299 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.462 ' O ' HG12 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -68.05 -20.26 64.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 109.31 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.446 ' O ' ' CG1' ' A' ' 9' ' ' ILE . 1.4 m -73.57 -47.59 39.39 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.329 -0.857 . . . . 0.0 109.323 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -76.72 -16.99 59.35 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.229 -0.919 . . . . 0.0 108.68 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' O ' ' CG ' ' A' ' 12' ' ' LEU . . . -83.5 -31.05 26.69 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.53 HG13 ' N ' ' A' ' 10' ' ' SER . 17.1 pt -76.19 -34.44 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.396 -0.815 . . . . 0.0 108.918 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.53 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.71 -56.38 7.38 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 108.692 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -60.76 -25.59 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.134 -0.979 . . . . 0.0 108.497 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.461 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 5.1 mt -61.16 -46.18 91.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -0.832 . . . . 0.0 109.116 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.59 ' N ' ' CD1' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.0 -24.28 60.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.47 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -64.72 0.82 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.312 -0.867 . . . . 0.0 109.717 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -46.33 87.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 109.823 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 12' ' ' LEU . . . -49.55 -26.85 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.099 -1.001 . . . . 0.0 109.204 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.7 t -85.19 -34.63 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 109.559 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -61.8 2.07 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.45 -31.75 70.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -0.908 . . . . 0.0 109.111 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 6.1 tp -69.09 -27.15 65.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.298 -0.876 . . . . 0.0 109.053 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.6 tp -71.36 -51.87 21.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.41 -0.806 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 t -71.75 -13.81 61.82 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.338 -0.851 . . . . 0.0 109.173 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.81 -41.28 45.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.363 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.59 -24.73 41.84 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.329 -0.857 . . . . 0.0 108.838 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.564 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.281 0.562 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.461 ' O ' HG21 ' A' ' 7' ' ' THR . 1.8 mptp? -75.52 -67.07 0.7 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.157 -0.965 . . . . 0.0 109.2 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 2.4 ttt -56.53 -19.25 14.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.212 -0.93 . . . . 0.0 109.124 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.454 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.3 t -82.88 -33.86 26.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.369 -0.832 . . . . 0.0 109.248 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.461 HG21 ' O ' ' A' ' 4' ' ' LYS . 14.6 t -77.13 -17.38 58.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.289 -0.882 . . . . 0.0 108.631 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.451 ' N ' HG21 ' A' ' 7' ' ' THR . . . -82.07 -38.89 24.23 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.488 ' O ' HD12 ' A' ' 13' ' ' LEU . 33.9 pt -69.15 -30.9 47.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.48 ' N ' HG13 ' A' ' 9' ' ' ILE . 75.4 m -67.48 -54.07 23.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.387 -0.821 . . . . 0.0 109.132 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 57.6 t -52.58 -35.34 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.177 -0.952 . . . . 0.0 108.971 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 15' ' ' GLN . 6.5 mt -58.61 -56.3 23.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 0.0 109.184 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' A' ' 13' ' ' LEU . 4.2 mp -54.75 -29.58 54.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.178 -0.951 . . . . 0.0 109.222 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 11' ' ' VAL . . . -57.08 -69.48 0.16 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 4.3 pt20 -52.17 -24.55 7.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.156 -0.965 . . . . 0.0 109.314 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.438 ' O ' ' HG ' ' A' ' 19' ' ' LEU . . . -66.65 -44.86 80.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.46 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.62 -40.94 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 109.365 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.449 ' O ' HG22 ' A' ' 22' ' ' THR . 62.9 t80 -54.46 -62.52 1.6 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.237 -0.915 . . . . 0.0 109.36 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 16' ' ' ALA . 3.0 pp -64.23 -18.12 64.23 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.332 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.59 -35.3 70.47 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.285 -0.885 . . . . 0.0 109.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.401 ' HA ' HD11 ' A' ' 21' ' ' LEU . 38.7 tp -77.13 -42.17 38.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.485 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 18' ' ' PHE . 2.2 p -66.73 -25.5 66.54 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.882 . . . . 0.0 109.577 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.6 OUTLIER -85.09 -33.8 22.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.343 -0.848 . . . . 0.0 109.814 -179.723 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.03 -15.68 57.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.161 -0.962 . . . . 0.0 109.716 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.543 -179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.44 -56.28 13.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.255 -0.903 . . . . 0.0 109.297 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.409 ' O ' HG22 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -57.79 -18.85 24.3 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.245 -0.909 . . . . 0.0 109.184 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' SER . 23.6 t -85.09 -31.33 23.42 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 109.406 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 48.1 m -81.44 -15.46 55.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 109.154 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.08 -45.9 11.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.515 HG13 ' N ' ' A' ' 10' ' ' SER . 1.2 pt -68.85 -27.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.515 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -75.45 -37.99 59.98 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.8 t -59.85 -39.54 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.299 -0.876 . . . . 0.0 108.964 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.28 -43.03 67.14 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.315 -0.866 . . . . 0.0 109.517 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.466 HD23 ' N ' ' A' ' 13' ' ' LEU . 3.1 mm? -71.28 -39.19 71.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.903 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.23 -51.8 41.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.234 -0.916 . . . . 0.0 109.527 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -39.44 85.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 109.582 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.01 -41.1 59.56 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.204 -0.935 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.446 HG11 ' O ' ' A' ' 17' ' ' VAL . 82.2 t -81.64 -26.42 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 0.0 109.431 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.25 -65.22 0.71 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.458 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.464 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 3.6 pp -53.57 -19.5 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.862 . . . . 0.0 109.649 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.6 -53.27 12.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.73 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 2.8 pp -65.7 -30.99 71.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 109.648 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.464 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 32.5 p -71.43 -35.58 71.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 109.495 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -66.9 -53.98 26.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.256 -0.902 . . . . 0.0 109.523 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.44 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -66.39 -18.91 65.63 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.44 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.466 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -63.73 -58.6 6.36 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.309 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.409 ' O ' HG21 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -55.52 -24.5 32.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 109.335 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.473 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.4 t -71.19 -36.76 72.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.39 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -16.94 57.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 108.826 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.04 -35.3 23.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.517 HG13 ' N ' ' A' ' 10' ' ' SER . 12.0 pt -75.88 -29.61 20.22 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.412 -0.805 . . . . 0.0 108.954 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.517 ' N ' HG13 ' A' ' 9' ' ' ILE . 52.9 p -73.24 -47.45 43.08 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.233 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -63.19 -31.86 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.194 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 6.8 mt -66.43 -49.74 65.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.29 -0.881 . . . . 0.0 109.375 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 13' ' ' LEU . 1.3 mp -62.81 -25.58 68.32 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.213 -0.93 . . . . 0.0 109.173 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -59.47 -74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.442 -0.786 . . . . 0.0 109.561 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.69 -11.76 55.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' ' HA ' ' A' ' 13' ' ' LEU . . . -67.31 -69.1 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.189 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.22 -28.76 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.874 . . . . 0.0 109.091 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -58.7 -68.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.41 -0.807 . . . . 0.0 109.287 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.474 ' CD1' ' C ' ' A' ' 19' ' ' LEU . 3.7 pp -53.9 -20.48 6.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.286 -0.883 . . . . 0.0 109.275 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.81 -47.51 77.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.051 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.505 HD21 ' N ' ' A' ' 21' ' ' LEU . 1.9 mt -64.76 -41.59 95.78 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.0 m -62.8 -27.39 69.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.409 -0.807 . . . . 0.0 109.048 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -44.83 67.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.374 -0.829 . . . . 0.0 109.234 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' OE1' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -70.41 -16.67 62.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.302 -0.874 . . . . 0.0 109.064 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 117.963 -1.017 . . . . 0.0 109.42 -179.814 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -69.76 -48.18 60.25 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.226 -0.921 . . . . 0.0 109.213 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.422 ' O ' HG21 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -65.98 -17.61 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.31 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -80.07 -35.91 36.33 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.304 -0.873 . . . . 0.0 109.177 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 90.8 m -80.61 -21.28 41.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.318 -0.863 . . . . 0.0 108.917 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.04 -37.94 19.77 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.356 -0.84 . . . . 0.0 108.816 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.466 ' O ' HD21 ' A' ' 13' ' ' LEU . 1.3 pp -71.12 -31.42 44.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 C-N-CA 119.712 -0.795 . . . . 0.0 108.916 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.76 -55.85 6.87 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.196 -0.94 . . . . 0.0 108.774 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.0 t -53.36 -26.27 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.235 -0.916 . . . . 0.0 108.671 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.2 mt -64.53 -59.73 3.97 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.391 -0.818 . . . . 0.0 108.953 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.499 HD23 ' N ' ' A' ' 13' ' ' LEU . 4.0 mm? -48.88 -29.7 4.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.178 -0.951 . . . . 0.0 108.708 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -56.62 16.17 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.482 -0.761 . . . . 0.0 109.307 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -52.06 -33.52 39.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.244 -0.91 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.2 91.45 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.228 -0.92 . . . . 0.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 56.0 t -59.23 -41.27 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.247 -0.908 . . . . 0.0 109.5 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.435 ' HA ' HD22 ' A' ' 21' ' ' LEU . 53.0 t80 -61.27 -56.79 16.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.126 -0.984 . . . . 0.0 109.225 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -15.7 42.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.913 . . . . 0.0 109.318 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 14.1 tp -70.37 -50.91 34.03 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.916 . . . . 0.0 109.161 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.481 ' HG ' ' N ' ' A' ' 22' ' ' THR . 1.7 pp -67.49 -27.63 67.17 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.214 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.481 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 63.5 m -82.41 -20.52 36.91 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.895 . . . . 0.0 109.507 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.9 m -82.21 -55.33 4.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 109.516 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.493 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -78.04 -26.95 48.65 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.14 -0.975 . . . . 0.0 109.145 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.493 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.942 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.215 0.531 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -59.0 6.15 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.938 . . . . 0.0 109.381 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.446 ' O ' HG21 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -53.89 -29.93 43.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.493 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.443 ' O ' HG12 ' A' ' 9' ' ' ILE . 8.4 t -70.62 -36.33 73.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.121 -0.987 . . . . 0.0 109.456 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.437 HG21 ' O ' ' A' ' 7' ' ' THR . 16.8 m -80.1 -17.48 52.48 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.287 -0.883 . . . . 0.0 109.074 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 12' ' ' LEU . . . -85.25 -32.74 22.42 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.497 HG13 ' N ' ' A' ' 10' ' ' SER . 24.3 pt -72.87 -43.24 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.517 -0.739 . . . . 0.0 109.3 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.497 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.35 -49.46 49.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.256 -0.903 . . . . 0.0 108.883 179.669 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.469 HG11 ' O ' ' A' ' 11' ' ' VAL . 77.6 t -61.32 -23.57 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.256 -0.902 . . . . 0.0 108.932 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 3.1 mt -65.46 -50.08 66.69 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.287 -0.883 . . . . 0.0 109.283 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.544 ' N ' ' CD2' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.64 -28.21 69.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 108.96 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -77.6 -25.41 49.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.519 ' CA ' ' OE1' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -79.52 -27.58 41.35 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.279 -0.888 . . . . 0.0 109.483 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.12 -47.98 77.07 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.901 . . . . 0.0 109.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.1 t -83.97 -30.07 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.729 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER -56.95 -62.01 2.04 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.121 -0.987 . . . . 0.0 109.603 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.425 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 87.4 mt -59.12 -28.36 66.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.541 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.4 tp -55.19 -56.25 22.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.94 . . . . 0.0 109.258 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 tp -60.04 -54.42 46.19 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.244 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 82.1 p -47.31 -28.07 1.84 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.29 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.2 t -71.04 -51.29 26.15 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.369 -0.832 . . . . 0.0 109.365 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -66.73 -9.89 41.33 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.33 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.479 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.278 0.561 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -58.2 7.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.162 -0.961 . . . . 0.0 109.433 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.465 ' O ' HG21 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.81 -21.2 66.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.151 -0.968 . . . . 0.0 109.507 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.451 ' O ' HG12 ' A' ' 9' ' ' ILE . 5.6 t -73.83 -36.75 64.96 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.29 -0.882 . . . . 0.0 109.409 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.7 -18.43 47.9 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.271 -0.893 . . . . 0.0 108.835 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.75 -30.92 28.65 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.521 HG13 ' N ' ' A' ' 10' ' ' SER . 33.3 pt -75.16 -39.96 43.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.521 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.3 OUTLIER -67.89 -36.61 80.53 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.312 -0.867 . . . . 0.0 108.683 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 21.4 t -60.02 -45.93 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.03 -55.63 16.54 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.282 -0.886 . . . . 0.0 109.136 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.509 HD23 ' N ' ' A' ' 13' ' ' LEU . 3.9 mm? -57.29 -31.9 66.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.162 -0.962 . . . . 0.0 108.937 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 11' ' ' VAL . . . -54.68 -57.1 12.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.295 -0.878 . . . . 0.0 108.888 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -59.19 -31.75 69.3 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.319 -0.863 . . . . 0.0 108.92 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.54 -36.57 76.39 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.307 -0.871 . . . . 0.0 108.933 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.7 t -78.42 -32.55 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.3 -0.875 . . . . 0.0 108.855 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.0 t80 -57.97 -59.83 4.66 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.381 -0.824 . . . . 0.0 108.947 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.73 -21.85 4.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.28 -0.888 . . . . 0.0 108.834 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 tt -66.51 -54.78 20.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.404 -0.81 . . . . 0.0 109.273 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 1.9 pp -64.49 -25.58 68.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.269 -0.894 . . . . 0.0 109.096 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -63.2 -49.3 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.319 -0.863 . . . . 0.0 109.348 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -47.84 66.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.242 -0.911 . . . . 0.0 109.159 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -71.53 -5.1 30.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.878 . . . . 0.0 109.389 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' LEU . 2.3 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.53 4.903 0 N-CA-C 119.45 2.54 . . . . 0.0 119.45 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.55 172.84 0.27 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -1.123 . . . . 0.0 109.544 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.59 -19.44 48.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.214 -0.929 . . . . 0.0 109.608 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.36 -61.65 1.89 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -17.93 63.93 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.198 -0.938 . . . . 0.0 109.177 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.6 t -78.25 -33.68 49.53 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.293 -0.879 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 p -83.98 -18.06 38.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.337 -0.852 . . . . 0.0 109.322 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.68 -40.82 15.74 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.28 -0.888 . . . . 0.0 108.733 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.526 ' O ' ' CD2' ' A' ' 13' ' ' LEU . 1.4 pp -75.09 -30.75 23.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 O-C-N 121.392 -0.818 . . . . 0.0 109.46 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.5 OUTLIER -77.64 -46.97 20.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.158 -0.963 . . . . 0.0 108.915 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 t -61.33 -27.44 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.282 -0.886 . . . . 0.0 108.833 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.8 mt -60.7 -47.46 86.16 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 0.0 109.425 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.526 ' CD2' ' O ' ' A' ' 9' ' ' ILE . 2.5 mm? -71.15 -38.57 72.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.116 -0.99 . . . . 0.0 109.245 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -46.24 -50.74 15.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.392 -0.817 . . . . 0.0 109.603 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.471 ' HA ' ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -69.13 -47.41 65.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.234 -0.916 . . . . 0.0 109.729 -179.782 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 15' ' ' GLN . . . -41.89 -52.57 4.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.395 -0.815 . . . . 0.0 110.127 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.405 HG11 ' O ' ' A' ' 17' ' ' VAL . 44.7 t -82.58 -23.68 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.131 -0.981 . . . . 0.0 109.919 -179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.471 ' HB2' ' HA ' ' A' ' 15' ' ' GLN . 2.4 t80 -53.4 -63.44 1.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.141 -0.974 . . . . 0.0 109.439 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 31.9 mt -61.23 -30.44 70.44 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 109.387 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.4 tp -61.13 -32.28 71.98 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.0 109.359 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.48 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 11.7 tp -80.62 -60.14 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.288 -0.882 . . . . 0.0 109.562 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.9 p -45.89 -34.36 3.8 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -0.863 . . . . 0.0 109.834 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.49 -47.76 31.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.0 109.702 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -83.45 10.99 7.58 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.235 -0.915 . . . . 0.0 109.596 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 4.0 mmt-85 . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.385 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.531 4.984 0 N-CA-C 119.526 2.571 . . . . 0.0 119.526 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 65.25 158.49 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.198 -1.177 . . . . 0.0 109.554 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.448 ' O ' ' OG1' ' A' ' 7' ' ' THR . 0.6 OUTLIER -61.52 -13.43 21.17 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.534 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.78 -53.25 10.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 0.0 109.514 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.418 ' SD ' HG22 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.67 -22.57 63.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.249 -0.907 . . . . 0.0 109.641 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.405 ' O ' HG13 ' A' ' 9' ' ' ILE . 47.0 t -80.43 -32.39 37.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.172 -0.955 . . . . 0.0 109.678 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.448 ' OG1' ' O ' ' A' ' 3' ' ' GLU . 1.6 p -82.18 -20.9 36.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.326 -0.859 . . . . 0.0 109.174 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.27 -40.93 17.4 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.423 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 2.5 pp -69.04 -32.78 55.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 73.5 m -67.85 -51.43 48.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.476 -0.765 . . . . 0.0 109.199 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.6 t -54.67 -34.36 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -0.918 . . . . 0.0 109.205 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.464 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 51.5 mt -61.53 -46.78 88.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 0.0 109.493 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -71.64 -21.31 61.84 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.203 -0.936 . . . . 0.0 109.095 -179.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -64.34 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.353 -0.842 . . . . 0.0 109.714 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -72.53 -22.96 60.94 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.163 -0.961 . . . . 0.0 109.704 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 12' ' ' LEU . . . -72.79 -72.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 50.7 t -55.58 -26.98 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 109.784 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 18' ' ' PHE . 2.1 t80 -63.28 -62.91 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.317 -0.864 . . . . 0.0 109.772 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' CB ' ' A' ' 23' ' ' SER . 83.7 mt -68.74 -16.84 63.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 110.015 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.434 ' C ' ' CD1' ' A' ' 20' ' ' LEU . 0.3 OUTLIER -67.69 -51.92 43.93 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.052 -1.03 . . . . 0.0 109.24 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.4 tp -66.75 -46.55 75.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 0.0 109.246 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -14.71 63.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -0.927 . . . . 0.0 109.215 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.444 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -78.65 -67.82 0.71 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -78.09 -3.44 42.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.311 -0.868 . . . . 0.0 109.674 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.484 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.449 ' HA3' ' HB3' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.528 4.832 0 N-CA-C 119.289 2.475 . . . . 0.0 119.289 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.41 ' O ' ' HB3' ' A' ' 6' ' ' SER . 1.9 t 67.47 -164.36 0.21 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.279 -1.13 . . . . 0.0 109.41 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.76 -14.18 62.65 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.22 -0.925 . . . . 0.0 109.267 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.57 -65.67 0.7 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.301 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.449 ' HB3' ' HA3' ' A' ' 1' ' ' GLY . 1.8 ttt -61.84 -25.46 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.109 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -74.44 -30.95 62.1 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.256 -0.903 . . . . 0.0 109.23 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 11' ' ' VAL . 98.4 m -79.16 -21.42 46.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.333 -0.855 . . . . 0.0 108.914 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -80.44 -37.92 31.08 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.519 HG13 ' N ' ' A' ' 10' ' ' SER . 35.8 pt -67.23 -37.47 79.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.519 ' N ' HG13 ' A' ' 9' ' ' ILE . 10.1 m -67.37 -38.57 84.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.355 -0.841 . . . . 0.0 109.012 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.463 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 82.3 t -59.25 -39.23 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.319 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.77 -45.26 94.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.11 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.587 ' N ' ' CD2' ' A' ' 13' ' ' LEU . 0.3 OUTLIER -66.34 -25.95 67.06 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.366 -0.833 . . . . 0.0 109.135 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 11' ' ' VAL . . . -50.2 -72.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.497 -0.752 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -58.62 -36.19 73.68 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.144 -0.972 . . . . 0.0 109.425 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.59 -38.18 20.02 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 109.654 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.441 ' O ' HD22 ' A' ' 21' ' ' LEU . 44.5 t -80.63 -36.05 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.951 . . . . 0.0 109.686 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.77 -56.83 7.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 23' ' ' SER . 2.9 pp -60.53 -29.45 69.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.08 -1.013 . . . . 0.0 108.697 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.59 -30.29 71.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.547 -0.721 . . . . 0.0 109.19 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.467 ' N ' ' CD2' ' A' ' 21' ' ' LEU . 2.0 mt -71.28 -51.11 26.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.36 -0.838 . . . . 0.0 108.957 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.1 p -73.91 -5.27 40.11 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.37 -0.831 . . . . 0.0 109.564 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.436 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -84.97 -61.95 1.65 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.932 . . . . 0.0 109.727 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ARG . 3.5 tt0 -74.57 -34.87 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.146 -0.971 . . . . 0.0 109.2 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.51 ' CG ' ' O ' ' A' ' 25' ' ' ARG . 2.6 ttt180 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.684 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.521 ' CA ' ' HB2' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.529 4.867 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 58.46 -148.23 0.48 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -1.135 . . . . 0.0 109.543 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -49.74 -40.12 39.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.166 -0.959 . . . . 0.0 109.475 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -46.12 81.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.261 -0.899 . . . . 0.0 109.299 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.521 ' HB2' ' CA ' ' A' ' 1' ' ' GLY . 0.6 OUTLIER -68.05 -20.26 64.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 109.31 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.446 ' O ' ' CG1' ' A' ' 9' ' ' ILE . 1.4 m -73.57 -47.59 39.39 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.329 -0.857 . . . . 0.0 109.323 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 p -76.72 -16.99 59.35 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.229 -0.919 . . . . 0.0 108.68 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' O ' ' CG ' ' A' ' 12' ' ' LEU . . . -83.5 -31.05 26.69 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.53 HG13 ' N ' ' A' ' 10' ' ' SER . 17.1 pt -76.19 -34.44 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.396 -0.815 . . . . 0.0 108.918 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.53 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.71 -56.38 7.38 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 108.692 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.2 t -60.76 -25.59 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.134 -0.979 . . . . 0.0 108.497 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.461 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 5.1 mt -61.16 -46.18 91.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -0.832 . . . . 0.0 109.116 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.59 ' N ' ' CD1' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.0 -24.28 60.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.47 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -64.72 0.82 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.312 -0.867 . . . . 0.0 109.717 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -46.33 87.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 109.823 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 12' ' ' LEU . . . -49.55 -26.85 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.099 -1.001 . . . . 0.0 109.204 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.7 t -85.19 -34.63 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 109.559 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -61.8 2.07 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.45 -31.75 70.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -0.908 . . . . 0.0 109.111 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.432 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 6.1 tp -69.09 -27.15 65.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.298 -0.876 . . . . 0.0 109.053 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.6 tp -71.36 -51.87 21.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.41 -0.806 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 t -71.75 -13.81 61.82 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.338 -0.851 . . . . 0.0 109.173 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.81 -41.28 45.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.363 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.59 -24.73 41.84 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.329 -0.857 . . . . 0.0 108.838 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.564 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.463 ' O ' ' O ' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.529 4.86 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.463 ' O ' ' O ' ' A' ' 1' ' ' GLY . 42.0 m 57.38 159.87 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.332 -1.099 . . . . 0.0 109.485 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.27 -16.92 15.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.923 . . . . 0.0 109.531 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.461 ' O ' HG21 ' A' ' 7' ' ' THR . 1.8 mptp? -75.52 -67.07 0.7 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.157 -0.965 . . . . 0.0 109.2 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.425 ' CB ' ' O ' ' A' ' 1' ' ' GLY . 2.4 ttt -56.53 -19.25 14.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.212 -0.93 . . . . 0.0 109.124 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.454 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.3 t -82.88 -33.86 26.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.369 -0.832 . . . . 0.0 109.248 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.461 HG21 ' O ' ' A' ' 4' ' ' LYS . 14.6 t -77.13 -17.38 58.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.289 -0.882 . . . . 0.0 108.631 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.451 ' N ' HG21 ' A' ' 7' ' ' THR . . . -82.07 -38.89 24.23 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.488 ' O ' HD12 ' A' ' 13' ' ' LEU . 33.9 pt -69.15 -30.9 47.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.48 ' N ' HG13 ' A' ' 9' ' ' ILE . 75.4 m -67.48 -54.07 23.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.387 -0.821 . . . . 0.0 109.132 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 57.6 t -52.58 -35.34 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.177 -0.952 . . . . 0.0 108.971 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 15' ' ' GLN . 6.5 mt -58.61 -56.3 23.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 0.0 109.184 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' A' ' 13' ' ' LEU . 4.2 mp -54.75 -29.58 54.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.178 -0.951 . . . . 0.0 109.222 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 11' ' ' VAL . . . -57.08 -69.48 0.16 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 4.3 pt20 -52.17 -24.55 7.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.156 -0.965 . . . . 0.0 109.314 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.438 ' O ' ' HG ' ' A' ' 19' ' ' LEU . . . -66.65 -44.86 80.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.46 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.62 -40.94 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 109.365 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.449 ' O ' HG22 ' A' ' 22' ' ' THR . 62.9 t80 -54.46 -62.52 1.6 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.237 -0.915 . . . . 0.0 109.36 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 16' ' ' ALA . 3.0 pp -64.23 -18.12 64.23 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.332 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.59 -35.3 70.47 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.285 -0.885 . . . . 0.0 109.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.401 ' HA ' HD11 ' A' ' 21' ' ' LEU . 38.7 tp -77.13 -42.17 38.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.485 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 18' ' ' PHE . 2.2 p -66.73 -25.5 66.54 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.882 . . . . 0.0 109.577 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.6 OUTLIER -85.09 -33.8 22.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.343 -0.848 . . . . 0.0 109.814 -179.723 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.03 -15.68 57.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.161 -0.962 . . . . 0.0 109.716 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.543 -179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.453 ' HA2' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 1 N--CA 1.528 4.815 0 N-CA-C 119.309 2.484 . . . . 0.0 119.309 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m -57.56 -45.23 85.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.334 -1.098 . . . . 0.0 109.561 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -56.89 -37.05 70.86 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.286 -0.883 . . . . 0.0 109.572 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HG2' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -65.44 -56.28 13.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.255 -0.903 . . . . 0.0 109.297 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.409 ' O ' HG22 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -57.79 -18.85 24.3 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.245 -0.909 . . . . 0.0 109.184 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' SER . 23.6 t -85.09 -31.33 23.42 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 109.406 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 48.1 m -81.44 -15.46 55.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 109.154 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.08 -45.9 11.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.515 HG13 ' N ' ' A' ' 10' ' ' SER . 1.2 pt -68.85 -27.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.515 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -75.45 -37.99 59.98 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.8 t -59.85 -39.54 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.299 -0.876 . . . . 0.0 108.964 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.4 mt -53.28 -43.03 67.14 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.315 -0.866 . . . . 0.0 109.517 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.466 HD23 ' N ' ' A' ' 13' ' ' LEU . 3.1 mm? -71.28 -39.19 71.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.903 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.23 -51.8 41.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.234 -0.916 . . . . 0.0 109.527 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -39.44 85.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 109.582 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.01 -41.1 59.56 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.204 -0.935 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.446 HG11 ' O ' ' A' ' 17' ' ' VAL . 82.2 t -81.64 -26.42 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 0.0 109.431 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.25 -65.22 0.71 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.458 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.464 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 3.6 pp -53.57 -19.5 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.862 . . . . 0.0 109.649 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.6 -53.27 12.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.73 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 2.8 pp -65.7 -30.99 71.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 109.648 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.464 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 32.5 p -71.43 -35.58 71.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 109.495 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -66.9 -53.98 26.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.256 -0.902 . . . . 0.0 109.523 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.44 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -66.39 -18.91 65.63 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.44 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.466 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.837 0 N-CA-C 119.406 2.523 . . . . 0.0 119.406 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 t -75.82 -83.67 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 109.592 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -47.67 -29.35 2.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.178 -0.951 . . . . 0.0 109.43 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -63.73 -58.6 6.36 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.309 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.409 ' O ' HG21 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -55.52 -24.5 32.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 109.335 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.473 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.4 t -71.19 -36.76 72.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.39 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -16.94 57.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 108.826 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.04 -35.3 23.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.517 HG13 ' N ' ' A' ' 10' ' ' SER . 12.0 pt -75.88 -29.61 20.22 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.412 -0.805 . . . . 0.0 108.954 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.517 ' N ' HG13 ' A' ' 9' ' ' ILE . 52.9 p -73.24 -47.45 43.08 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.233 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -63.19 -31.86 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.194 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 6.8 mt -66.43 -49.74 65.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.29 -0.881 . . . . 0.0 109.375 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 13' ' ' LEU . 1.3 mp -62.81 -25.58 68.32 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.213 -0.93 . . . . 0.0 109.173 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -59.47 -74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.442 -0.786 . . . . 0.0 109.561 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.69 -11.76 55.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.461 ' HB1' ' HA ' ' A' ' 13' ' ' LEU . . . -67.31 -69.1 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.189 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.22 -28.76 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.874 . . . . 0.0 109.091 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -58.7 -68.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.41 -0.807 . . . . 0.0 109.287 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.474 ' CD1' ' C ' ' A' ' 19' ' ' LEU . 3.7 pp -53.9 -20.48 6.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.286 -0.883 . . . . 0.0 109.275 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.81 -47.51 77.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.051 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.505 HD21 ' N ' ' A' ' 21' ' ' LEU . 1.9 mt -64.76 -41.59 95.78 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.0 m -62.8 -27.39 69.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.409 -0.807 . . . . 0.0 109.048 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -44.83 67.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.374 -0.829 . . . . 0.0 109.234 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' N ' ' OE1' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -70.41 -16.67 62.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.302 -0.874 . . . . 0.0 109.064 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 117.963 -1.017 . . . . 0.0 109.42 -179.814 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.804 0 N-CA-C 119.392 2.517 . . . . 0.0 119.392 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 p -78.06 -50.05 12.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -1.152 . . . . 0.0 109.612 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -60.97 -38.0 84.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.378 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -69.76 -48.18 60.25 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.226 -0.921 . . . . 0.0 109.213 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.422 ' O ' HG21 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -65.98 -17.61 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.31 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -80.07 -35.91 36.33 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.304 -0.873 . . . . 0.0 109.177 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 90.8 m -80.61 -21.28 41.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.318 -0.863 . . . . 0.0 108.917 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.04 -37.94 19.77 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.356 -0.84 . . . . 0.0 108.816 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.466 ' O ' HD21 ' A' ' 13' ' ' LEU . 1.3 pp -71.12 -31.42 44.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 C-N-CA 119.712 -0.795 . . . . 0.0 108.916 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.76 -55.85 6.87 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.196 -0.94 . . . . 0.0 108.774 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.0 t -53.36 -26.27 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.235 -0.916 . . . . 0.0 108.671 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 12.2 mt -64.53 -59.73 3.97 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.391 -0.818 . . . . 0.0 108.953 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.499 HD23 ' N ' ' A' ' 13' ' ' LEU . 4.0 mm? -48.88 -29.7 4.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.178 -0.951 . . . . 0.0 108.708 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.59 -56.62 16.17 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.482 -0.761 . . . . 0.0 109.307 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -52.06 -33.52 39.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.244 -0.91 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.2 91.45 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.228 -0.92 . . . . 0.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.448 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 56.0 t -59.23 -41.27 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.247 -0.908 . . . . 0.0 109.5 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.435 ' HA ' HD22 ' A' ' 21' ' ' LEU . 53.0 t80 -61.27 -56.79 16.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.126 -0.984 . . . . 0.0 109.225 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -15.7 42.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.913 . . . . 0.0 109.318 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 14.1 tp -70.37 -50.91 34.03 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.916 . . . . 0.0 109.161 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.481 ' HG ' ' N ' ' A' ' 22' ' ' THR . 1.7 pp -67.49 -27.63 67.17 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.214 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.481 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 63.5 m -82.41 -20.52 36.91 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.895 . . . . 0.0 109.507 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.9 m -82.21 -55.33 4.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 109.516 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.493 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -78.04 -26.95 48.65 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.14 -0.975 . . . . 0.0 109.145 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.493 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.942 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.48 ' HA2' ' CG ' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.528 4.803 0 N-CA-C 119.561 2.585 . . . . 0.0 119.561 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.437 ' CB ' ' O ' ' A' ' 1' ' ' GLY . 0.7 OUTLIER 70.9 -176.53 0.2 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.345 -1.091 . . . . 0.0 110.006 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -47.17 -30.1 2.7 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.31 -0.869 . . . . 0.0 109.626 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -59.0 6.15 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.938 . . . . 0.0 109.381 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.48 ' CG ' ' HA2' ' A' ' 1' ' ' GLY . 0.0 OUTLIER -53.89 -29.93 43.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.493 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.443 ' O ' HG12 ' A' ' 9' ' ' ILE . 8.4 t -70.62 -36.33 73.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.121 -0.987 . . . . 0.0 109.456 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.437 ' O ' HG21 ' A' ' 7' ' ' THR . 16.8 m -80.1 -17.48 52.48 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.287 -0.883 . . . . 0.0 109.074 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.488 ' O ' ' CD1' ' A' ' 12' ' ' LEU . . . -85.25 -32.74 22.42 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.497 HG13 ' N ' ' A' ' 10' ' ' SER . 24.3 pt -72.87 -43.24 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.517 -0.739 . . . . 0.0 109.3 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.497 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.35 -49.46 49.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.256 -0.903 . . . . 0.0 108.883 179.669 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.469 HG11 ' O ' ' A' ' 11' ' ' VAL . 77.6 t -61.32 -23.57 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.256 -0.902 . . . . 0.0 108.932 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.488 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 3.1 mt -65.46 -50.08 66.69 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.287 -0.883 . . . . 0.0 109.283 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.544 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.64 -28.21 69.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 108.96 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -77.6 -25.41 49.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.519 ' OE1' ' CA ' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -79.52 -27.58 41.35 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.279 -0.888 . . . . 0.0 109.483 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.12 -47.98 77.07 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.901 . . . . 0.0 109.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.1 t -83.97 -30.07 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.729 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER -56.95 -62.01 2.04 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.121 -0.987 . . . . 0.0 109.603 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.425 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 87.4 mt -59.12 -28.36 66.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.541 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 5.4 tp -55.19 -56.25 22.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.94 . . . . 0.0 109.258 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 tp -60.04 -54.42 46.19 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.244 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 82.1 p -47.31 -28.07 1.84 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.29 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.2 t -71.04 -51.29 26.15 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.369 -0.832 . . . . 0.0 109.365 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -66.73 -9.89 41.33 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.33 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.479 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.528 4.822 0 N-CA-C 119.341 2.497 . . . . 0.0 119.341 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' A' ' 1' ' ' GLY . 51.0 m 64.05 171.92 0.18 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.315 -1.109 . . . . 0.0 109.497 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -59.37 -22.33 61.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.358 -0.839 . . . . 0.0 109.625 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -58.2 7.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.162 -0.961 . . . . 0.0 109.433 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.465 ' O ' HG21 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.81 -21.2 66.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.151 -0.968 . . . . 0.0 109.507 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.451 ' O ' HG12 ' A' ' 9' ' ' ILE . 5.6 t -73.83 -36.75 64.96 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.29 -0.882 . . . . 0.0 109.409 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.7 -18.43 47.9 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.271 -0.893 . . . . 0.0 108.835 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.75 -30.92 28.65 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.521 HG13 ' N ' ' A' ' 10' ' ' SER . 33.3 pt -75.16 -39.96 43.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.521 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.3 OUTLIER -67.89 -36.61 80.53 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.312 -0.867 . . . . 0.0 108.683 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.433 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 21.4 t -60.02 -45.93 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.03 -55.63 16.54 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.282 -0.886 . . . . 0.0 109.136 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.509 HD23 ' N ' ' A' ' 13' ' ' LEU . 3.9 mm? -57.29 -31.9 66.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.162 -0.962 . . . . 0.0 108.937 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 11' ' ' VAL . . . -54.68 -57.1 12.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.295 -0.878 . . . . 0.0 108.888 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -59.19 -31.75 69.3 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.319 -0.863 . . . . 0.0 108.92 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.54 -36.57 76.39 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.307 -0.871 . . . . 0.0 108.933 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.7 t -78.42 -32.55 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.3 -0.875 . . . . 0.0 108.855 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.0 t80 -57.97 -59.83 4.66 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.381 -0.824 . . . . 0.0 108.947 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.73 -21.85 4.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.28 -0.888 . . . . 0.0 108.834 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.8 tt -66.51 -54.78 20.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.404 -0.81 . . . . 0.0 109.273 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 18' ' ' PHE . 1.9 pp -64.49 -25.58 68.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.269 -0.894 . . . . 0.0 109.096 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -63.2 -49.3 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.319 -0.863 . . . . 0.0 109.348 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -47.84 66.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.242 -0.911 . . . . 0.0 109.159 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -71.53 -5.1 30.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.878 . . . . 0.0 109.389 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' LEU . 2.3 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.211 0.529 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.36 -61.65 1.89 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.12 -17.93 63.93 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.198 -0.938 . . . . 0.0 109.177 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.6 t -78.25 -33.68 49.53 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.293 -0.879 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 p -83.98 -18.06 38.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.337 -0.852 . . . . 0.0 109.322 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.68 -40.82 15.74 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.28 -0.888 . . . . 0.0 108.733 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.526 ' O ' ' CD2' ' A' ' 13' ' ' LEU . 1.4 pp -75.09 -30.75 23.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 O-C-N 121.392 -0.818 . . . . 0.0 109.46 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.5 OUTLIER -77.64 -46.97 20.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.158 -0.963 . . . . 0.0 108.915 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 t -61.33 -27.44 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.282 -0.886 . . . . 0.0 108.833 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 12' ' ' LEU . 8.8 mt -60.7 -47.46 86.16 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 0.0 109.425 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -71.15 -38.57 72.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.116 -0.99 . . . . 0.0 109.245 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -46.24 -50.74 15.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.392 -0.817 . . . . 0.0 109.603 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.508 ' HA ' ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -69.13 -47.41 65.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.234 -0.916 . . . . 0.0 109.729 -179.782 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 15' ' ' GLN . . . -41.89 -52.57 4.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.395 -0.815 . . . . 0.0 110.127 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.7 t -82.58 -23.68 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.131 -0.981 . . . . 0.0 109.919 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.508 ' HB2' ' HA ' ' A' ' 15' ' ' GLN . 2.4 t80 -53.4 -63.44 1.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.141 -0.974 . . . . 0.0 109.439 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 31.9 mt -61.23 -30.44 70.44 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 109.387 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.451 ' HA ' HD12 ' A' ' 20' ' ' LEU . 14.4 tp -61.13 -32.28 71.98 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.0 109.359 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 11.7 tp -80.62 -60.14 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.288 -0.882 . . . . 0.0 109.562 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.9 p -45.89 -34.36 3.8 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -0.863 . . . . 0.0 109.834 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.49 -47.76 31.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.0 109.702 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -83.45 10.99 7.58 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.235 -0.915 . . . . 0.0 109.596 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 4.0 mmt-85 . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.385 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.273 0.559 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.78 -53.25 10.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 0.0 109.514 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.618 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.67 -22.57 63.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.249 -0.907 . . . . 0.0 109.641 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.418 ' O ' HG13 ' A' ' 9' ' ' ILE . 47.0 t -80.43 -32.39 37.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.172 -0.955 . . . . 0.0 109.678 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.6 p -82.18 -20.9 36.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.326 -0.859 . . . . 0.0 109.174 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.27 -40.93 17.4 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.618 HG23 ' O ' ' A' ' 5' ' ' MET . 2.5 pp -69.04 -32.78 55.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 73.5 m -67.85 -51.43 48.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.476 -0.765 . . . . 0.0 109.199 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.6 t -54.67 -34.36 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -0.918 . . . . 0.0 109.205 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 12' ' ' LEU . 51.5 mt -61.53 -46.78 88.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 0.0 109.493 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.817 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -71.64 -21.31 61.84 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.203 -0.936 . . . . 0.0 109.095 -179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -64.34 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.353 -0.842 . . . . 0.0 109.714 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -72.53 -22.96 60.94 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.163 -0.961 . . . . 0.0 109.704 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.424 ' HB3' ' HA ' ' A' ' 13' ' ' LEU . . . -72.79 -72.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 50.7 t -55.58 -26.98 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 109.784 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.489 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 2.1 t80 -63.28 -62.91 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.317 -0.864 . . . . 0.0 109.772 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' CB ' ' A' ' 23' ' ' SER . 83.7 mt -68.74 -16.84 63.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 110.015 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 20' ' ' LEU . 0.3 OUTLIER -67.69 -51.92 43.93 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.052 -1.03 . . . . 0.0 109.24 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.4 tp -66.75 -46.55 75.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 0.0 109.246 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -14.71 63.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -0.927 . . . . 0.0 109.215 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.444 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -78.65 -67.82 0.71 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.09 -3.44 42.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.311 -0.868 . . . . 0.0 109.674 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.484 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.57 -65.67 0.7 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.301 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.479 ' O ' HG23 ' A' ' 9' ' ' ILE . 1.8 ttt -61.84 -25.46 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.109 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -74.44 -30.95 62.1 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.256 -0.903 . . . . 0.0 109.23 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.808 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.4 m -79.16 -21.42 46.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.333 -0.855 . . . . 0.0 108.914 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -80.44 -37.92 31.08 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.531 HG13 ' N ' ' A' ' 10' ' ' SER . 35.8 pt -67.23 -37.47 79.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.531 ' N ' HG13 ' A' ' 9' ' ' ILE . 10.1 m -67.37 -38.57 84.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.355 -0.841 . . . . 0.0 109.012 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.808 HG23 ' O ' ' A' ' 7' ' ' THR . 82.3 t -59.25 -39.23 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.319 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.77 -45.26 94.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.11 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.815 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -66.34 -25.95 67.06 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.366 -0.833 . . . . 0.0 109.135 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -50.2 -72.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.497 -0.752 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -58.62 -36.19 73.68 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.144 -0.972 . . . . 0.0 109.425 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.59 -38.18 20.02 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 109.654 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.736 HG12 HD21 ' A' ' 21' ' ' LEU . 44.5 t -80.63 -36.05 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.951 . . . . 0.0 109.686 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.77 -56.83 7.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 23' ' ' SER . 2.9 pp -60.53 -29.45 69.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.08 -1.013 . . . . 0.0 108.697 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.59 -30.29 71.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.547 -0.721 . . . . 0.0 109.19 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 17' ' ' VAL . 2.0 mt -71.28 -51.11 26.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.36 -0.838 . . . . 0.0 108.957 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.1 p -73.91 -5.27 40.11 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.37 -0.831 . . . . 0.0 109.564 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -84.97 -61.95 1.65 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.932 . . . . 0.0 109.727 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ARG . 3.5 tt0 -74.57 -34.87 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.146 -0.971 . . . . 0.0 109.2 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 2.6 ttt180 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.684 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.3 0.571 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -46.12 81.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.261 -0.899 . . . . 0.0 109.299 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -68.05 -20.26 64.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 109.31 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.446 ' O ' ' CG1' ' A' ' 9' ' ' ILE . 1.4 m -73.57 -47.59 39.39 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.329 -0.857 . . . . 0.0 109.323 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 11' ' ' VAL . 1.7 p -76.72 -16.99 59.35 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.229 -0.919 . . . . 0.0 108.68 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' O ' ' CG ' ' A' ' 12' ' ' LEU . . . -83.5 -31.05 26.69 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.897 HG23 ' O ' ' A' ' 5' ' ' MET . 17.1 pt -76.19 -34.44 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.396 -0.815 . . . . 0.0 108.918 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.71 -56.38 7.38 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 108.692 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 7' ' ' THR . 38.2 t -60.76 -25.59 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.134 -0.979 . . . . 0.0 108.497 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 9' ' ' ILE . 5.1 mt -61.16 -46.18 91.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -0.832 . . . . 0.0 109.116 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.59 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.0 -24.28 60.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.47 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -64.72 0.82 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.312 -0.867 . . . . 0.0 109.717 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -46.33 87.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 109.823 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -49.55 -26.85 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.099 -1.001 . . . . 0.0 109.204 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' LEU . 48.7 t -85.19 -34.63 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 109.559 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -61.8 2.07 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.45 -31.75 70.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -0.908 . . . . 0.0 109.111 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 6.1 tp -69.09 -27.15 65.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.298 -0.876 . . . . 0.0 109.053 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.6 tp -71.36 -51.87 21.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.41 -0.806 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 t -71.75 -13.81 61.82 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.338 -0.851 . . . . 0.0 109.173 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.81 -41.28 45.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.363 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.59 -24.73 41.84 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.329 -0.857 . . . . 0.0 108.838 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.564 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.281 0.562 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.822 ' O ' HG22 ' A' ' 7' ' ' THR . 1.8 mptp? -75.52 -67.07 0.7 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.157 -0.965 . . . . 0.0 109.2 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.479 ' O ' HG23 ' A' ' 9' ' ' ILE . 2.4 ttt -56.53 -19.25 14.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.212 -0.93 . . . . 0.0 109.124 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.46 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.3 t -82.88 -33.86 26.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.369 -0.832 . . . . 0.0 109.248 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.822 HG22 ' O ' ' A' ' 4' ' ' LYS . 14.6 t -77.13 -17.38 58.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.289 -0.882 . . . . 0.0 108.631 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.07 -38.89 24.23 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.501 ' O ' HD13 ' A' ' 13' ' ' LEU . 33.9 pt -69.15 -30.9 47.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 9' ' ' ILE . 75.4 m -67.48 -54.07 23.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.387 -0.821 . . . . 0.0 109.132 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 57.6 t -52.58 -35.34 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.177 -0.952 . . . . 0.0 108.971 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.489 ' O ' ' HG2' ' A' ' 15' ' ' GLN . 6.5 mt -58.61 -56.3 23.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 0.0 109.184 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.535 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.2 mp -54.75 -29.58 54.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.178 -0.951 . . . . 0.0 109.222 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -57.08 -69.48 0.16 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 4.3 pt20 -52.17 -24.55 7.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.156 -0.965 . . . . 0.0 109.314 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -66.65 -44.86 80.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.46 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.62 -40.94 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 109.365 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 22' ' ' THR . 62.9 t80 -54.46 -62.52 1.6 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.237 -0.915 . . . . 0.0 109.36 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.589 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.0 pp -64.23 -18.12 64.23 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.332 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.59 -35.3 70.47 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.285 -0.885 . . . . 0.0 109.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.437 HD11 ' CZ ' ' A' ' 25' ' ' ARG . 38.7 tp -77.13 -42.17 38.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.485 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 18' ' ' PHE . 2.2 p -66.73 -25.5 66.54 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.882 . . . . 0.0 109.577 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.6 OUTLIER -85.09 -33.8 22.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.343 -0.848 . . . . 0.0 109.814 -179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.03 -15.68 57.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.161 -0.962 . . . . 0.0 109.716 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CZ ' HD11 ' A' ' 21' ' ' LEU . 3.0 tpp180 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.543 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -65.44 -56.28 13.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.255 -0.903 . . . . 0.0 109.297 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -18.85 24.3 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.245 -0.909 . . . . 0.0 109.184 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 10' ' ' SER . 23.6 t -85.09 -31.33 23.42 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 109.406 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.782 ' O ' HG23 ' A' ' 11' ' ' VAL . 48.1 m -81.44 -15.46 55.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 109.154 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.08 -45.9 11.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.551 ' HA ' HD12 ' A' ' 12' ' ' LEU . 1.2 pt -68.85 -27.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.517 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -75.45 -37.99 59.98 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.294 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 7' ' ' THR . 39.8 t -59.85 -39.54 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.299 -0.876 . . . . 0.0 108.964 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 9' ' ' ILE . 63.4 mt -53.28 -43.03 67.14 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.315 -0.866 . . . . 0.0 109.517 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.657 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.1 mm? -71.28 -39.19 71.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.903 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.23 -51.8 41.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.234 -0.916 . . . . 0.0 109.527 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -39.44 85.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 109.582 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.01 -41.1 59.56 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.204 -0.935 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 82.2 t -81.64 -26.42 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 0.0 109.431 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.25 -65.22 0.71 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.458 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.472 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 3.6 pp -53.57 -19.5 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.862 . . . . 0.0 109.649 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.6 -53.27 12.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.73 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.59 ' C ' HD12 ' A' ' 21' ' ' LEU . 2.8 pp -65.7 -30.99 71.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 109.648 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 32.5 p -71.43 -35.58 71.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 109.495 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -66.9 -53.98 26.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.256 -0.902 . . . . 0.0 109.523 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.437 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -66.39 -18.91 65.63 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.466 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -63.73 -58.6 6.36 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.309 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.489 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -55.52 -24.5 32.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 109.335 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.491 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.4 t -71.19 -36.76 72.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.39 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -16.94 57.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 108.826 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.499 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -84.04 -35.3 23.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.526 HG13 ' N ' ' A' ' 10' ' ' SER . 12.0 pt -75.88 -29.61 20.22 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.412 -0.805 . . . . 0.0 108.954 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.526 ' N ' HG13 ' A' ' 9' ' ' ILE . 52.9 p -73.24 -47.45 43.08 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.233 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -63.19 -31.86 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.194 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 8' ' ' ALA . 6.8 mt -66.43 -49.74 65.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.29 -0.881 . . . . 0.0 109.375 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.3 mp -62.81 -25.58 68.32 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.213 -0.93 . . . . 0.0 109.173 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -59.47 -74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.442 -0.786 . . . . 0.0 109.561 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.69 -11.76 55.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 12' ' ' LEU . . . -67.31 -69.1 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.189 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.22 -28.76 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.874 . . . . 0.0 109.091 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -58.7 -68.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.41 -0.807 . . . . 0.0 109.287 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.724 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.7 pp -53.9 -20.48 6.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.286 -0.883 . . . . 0.0 109.275 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.81 -47.51 77.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.051 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.558 ' N ' HD23 ' A' ' 21' ' ' LEU . 1.9 mt -64.76 -41.59 95.78 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.0 m -62.8 -27.39 69.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.409 -0.807 . . . . 0.0 109.048 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -44.83 67.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.374 -0.829 . . . . 0.0 109.234 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' OE1' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -70.41 -16.67 62.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.302 -0.874 . . . . 0.0 109.064 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 117.963 -1.017 . . . . 0.0 109.42 -179.814 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -69.76 -48.18 60.25 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.226 -0.921 . . . . 0.0 109.213 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.747 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -65.98 -17.61 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.31 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.483 ' HA ' HG12 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -80.07 -35.91 36.33 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.304 -0.873 . . . . 0.0 109.177 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 90.8 m -80.61 -21.28 41.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.318 -0.863 . . . . 0.0 108.917 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.04 -37.94 19.77 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.356 -0.84 . . . . 0.0 108.816 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 5' ' ' MET . 1.3 pp -71.12 -31.42 44.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 C-N-CA 119.712 -0.795 . . . . 0.0 108.916 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.76 -55.85 6.87 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.196 -0.94 . . . . 0.0 108.774 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.0 t -53.36 -26.27 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.235 -0.916 . . . . 0.0 108.671 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 12' ' ' LEU . 12.2 mt -64.53 -59.73 3.97 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.391 -0.818 . . . . 0.0 108.953 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.525 HD22 ' N ' ' A' ' 13' ' ' LEU . 4.0 mm? -48.88 -29.7 4.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.178 -0.951 . . . . 0.0 108.708 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -62.59 -56.62 16.17 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.482 -0.761 . . . . 0.0 109.307 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -52.06 -33.52 39.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.244 -0.91 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.2 91.45 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.228 -0.92 . . . . 0.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.462 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 56.0 t -59.23 -41.27 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.247 -0.908 . . . . 0.0 109.5 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.418 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.0 t80 -61.27 -56.79 16.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.126 -0.984 . . . . 0.0 109.225 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -15.7 42.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.913 . . . . 0.0 109.318 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.462 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 14.1 tp -70.37 -50.91 34.03 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.916 . . . . 0.0 109.161 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 22' ' ' THR . 1.7 pp -67.49 -27.63 67.17 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.214 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.486 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 63.5 m -82.41 -20.52 36.91 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.895 . . . . 0.0 109.507 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.9 m -82.21 -55.33 4.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 109.516 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -78.04 -26.95 48.65 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.14 -0.975 . . . . 0.0 109.145 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.491 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.942 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.215 0.531 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -59.0 6.15 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.938 . . . . 0.0 109.381 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.554 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -53.89 -29.93 43.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.493 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 9' ' ' ILE . 8.4 t -70.62 -36.33 73.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.121 -0.987 . . . . 0.0 109.456 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 11' ' ' VAL . 16.8 m -80.1 -17.48 52.48 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.287 -0.883 . . . . 0.0 109.074 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -85.25 -32.74 22.42 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 12' ' ' LEU . 24.3 pt -72.87 -43.24 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.517 -0.739 . . . . 0.0 109.3 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.508 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.35 -49.46 49.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.256 -0.903 . . . . 0.0 108.883 179.669 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 7' ' ' THR . 77.6 t -61.32 -23.57 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.256 -0.902 . . . . 0.0 108.932 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' ALA . 3.1 mt -65.46 -50.08 66.69 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.287 -0.883 . . . . 0.0 109.283 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.831 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.64 -28.21 69.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 108.96 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -77.6 -25.41 49.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.519 ' CA ' ' OE1' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -79.52 -27.58 41.35 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.279 -0.888 . . . . 0.0 109.483 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.12 -47.98 77.07 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.901 . . . . 0.0 109.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.1 t -83.97 -30.07 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.729 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER -56.95 -62.01 2.04 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.121 -0.987 . . . . 0.0 109.603 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.433 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 87.4 mt -59.12 -28.36 66.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.541 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 20' ' ' LEU . 5.4 tp -55.19 -56.25 22.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.94 . . . . 0.0 109.258 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 tp -60.04 -54.42 46.19 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.244 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 82.1 p -47.31 -28.07 1.84 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.29 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.2 t -71.04 -51.29 26.15 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.369 -0.832 . . . . 0.0 109.365 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -66.73 -9.89 41.33 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.33 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.479 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.278 0.561 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -58.2 7.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.162 -0.961 . . . . 0.0 109.433 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.81 -21.2 66.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.151 -0.968 . . . . 0.0 109.507 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 9' ' ' ILE . 5.6 t -73.83 -36.75 64.96 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.29 -0.882 . . . . 0.0 109.409 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.602 ' O ' HG23 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -80.7 -18.43 47.9 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.271 -0.893 . . . . 0.0 108.835 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.75 -30.92 28.65 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 5' ' ' MET . 33.3 pt -75.16 -39.96 43.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.532 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.3 OUTLIER -67.89 -36.61 80.53 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.312 -0.867 . . . . 0.0 108.683 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 7' ' ' THR . 21.4 t -60.02 -45.93 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.03 -55.63 16.54 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.282 -0.886 . . . . 0.0 109.136 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.9 mm? -57.29 -31.9 66.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.162 -0.962 . . . . 0.0 108.937 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -54.68 -57.1 12.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.295 -0.878 . . . . 0.0 108.888 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -59.19 -31.75 69.3 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.319 -0.863 . . . . 0.0 108.92 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -59.54 -36.57 76.39 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.307 -0.871 . . . . 0.0 108.933 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.7 t -78.42 -32.55 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.3 -0.875 . . . . 0.0 108.855 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.0 t80 -57.97 -59.83 4.66 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.381 -0.824 . . . . 0.0 108.947 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.73 -21.85 4.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.28 -0.888 . . . . 0.0 108.834 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 20' ' ' LEU . 3.8 tt -66.51 -54.78 20.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.404 -0.81 . . . . 0.0 109.273 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.45 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.9 pp -64.49 -25.58 68.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.269 -0.894 . . . . 0.0 109.096 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -63.2 -49.3 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.319 -0.863 . . . . 0.0 109.348 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -47.84 66.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.242 -0.911 . . . . 0.0 109.159 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -71.53 -5.1 30.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.878 . . . . 0.0 109.389 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' LEU . 2.3 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.53 4.903 0 N-CA-C 119.45 2.54 . . . . 0.0 119.45 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.55 172.84 0.27 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -1.123 . . . . 0.0 109.544 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.59 -19.44 48.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.214 -0.929 . . . . 0.0 109.608 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.36 -61.65 1.89 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.12 -17.93 63.93 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.198 -0.938 . . . . 0.0 109.177 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.6 t -78.25 -33.68 49.53 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.293 -0.879 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 p -83.98 -18.06 38.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.337 -0.852 . . . . 0.0 109.322 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.68 -40.82 15.74 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.28 -0.888 . . . . 0.0 108.733 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.526 ' O ' ' CD2' ' A' ' 13' ' ' LEU . 1.4 pp -75.09 -30.75 23.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 O-C-N 121.392 -0.818 . . . . 0.0 109.46 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.5 OUTLIER -77.64 -46.97 20.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.158 -0.963 . . . . 0.0 108.915 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 t -61.33 -27.44 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.282 -0.886 . . . . 0.0 108.833 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 12' ' ' LEU . 8.8 mt -60.7 -47.46 86.16 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 0.0 109.425 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -71.15 -38.57 72.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.116 -0.99 . . . . 0.0 109.245 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -46.24 -50.74 15.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.392 -0.817 . . . . 0.0 109.603 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.508 ' HA ' ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -69.13 -47.41 65.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.234 -0.916 . . . . 0.0 109.729 -179.782 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 15' ' ' GLN . . . -41.89 -52.57 4.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.395 -0.815 . . . . 0.0 110.127 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.7 t -82.58 -23.68 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.131 -0.981 . . . . 0.0 109.919 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.508 ' HB2' ' HA ' ' A' ' 15' ' ' GLN . 2.4 t80 -53.4 -63.44 1.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.141 -0.974 . . . . 0.0 109.439 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 31.9 mt -61.23 -30.44 70.44 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 109.387 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.451 ' HA ' HD12 ' A' ' 20' ' ' LEU . 14.4 tp -61.13 -32.28 71.98 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.0 109.359 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 11.7 tp -80.62 -60.14 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.288 -0.882 . . . . 0.0 109.562 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.9 p -45.89 -34.36 3.8 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -0.863 . . . . 0.0 109.834 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.49 -47.76 31.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.0 109.702 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -83.45 10.99 7.58 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.235 -0.915 . . . . 0.0 109.596 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 4.0 mmt-85 . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.385 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.531 4.984 0 N-CA-C 119.526 2.571 . . . . 0.0 119.526 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 65.25 158.49 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.198 -1.177 . . . . 0.0 109.554 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -13.43 21.17 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.534 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.78 -53.25 10.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 0.0 109.514 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.618 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.67 -22.57 63.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.249 -0.907 . . . . 0.0 109.641 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.418 ' O ' HG13 ' A' ' 9' ' ' ILE . 47.0 t -80.43 -32.39 37.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.172 -0.955 . . . . 0.0 109.678 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.6 p -82.18 -20.9 36.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.326 -0.859 . . . . 0.0 109.174 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.27 -40.93 17.4 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.618 HG23 ' O ' ' A' ' 5' ' ' MET . 2.5 pp -69.04 -32.78 55.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 73.5 m -67.85 -51.43 48.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.476 -0.765 . . . . 0.0 109.199 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.6 t -54.67 -34.36 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -0.918 . . . . 0.0 109.205 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 12' ' ' LEU . 51.5 mt -61.53 -46.78 88.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 0.0 109.493 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.817 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -71.64 -21.31 61.84 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.203 -0.936 . . . . 0.0 109.095 -179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -64.34 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.353 -0.842 . . . . 0.0 109.714 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -72.53 -22.96 60.94 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.163 -0.961 . . . . 0.0 109.704 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.424 ' HB3' ' HA ' ' A' ' 13' ' ' LEU . . . -72.79 -72.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 50.7 t -55.58 -26.98 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 109.784 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.489 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 2.1 t80 -63.28 -62.91 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.317 -0.864 . . . . 0.0 109.772 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' CB ' ' A' ' 23' ' ' SER . 83.7 mt -68.74 -16.84 63.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 110.015 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 20' ' ' LEU . 0.3 OUTLIER -67.69 -51.92 43.93 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.052 -1.03 . . . . 0.0 109.24 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.4 tp -66.75 -46.55 75.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 0.0 109.246 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -14.71 63.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -0.927 . . . . 0.0 109.215 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.444 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -78.65 -67.82 0.71 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -78.09 -3.44 42.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.311 -0.868 . . . . 0.0 109.674 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.484 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.493 ' HA3' ' HB3' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.528 4.832 0 N-CA-C 119.289 2.475 . . . . 0.0 119.289 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.411 ' O ' ' HB3' ' A' ' 6' ' ' SER . 1.9 t 67.47 -164.36 0.21 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.279 -1.13 . . . . 0.0 109.41 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.76 -14.18 62.65 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.22 -0.925 . . . . 0.0 109.267 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.57 -65.67 0.7 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.301 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.493 ' HB3' ' HA3' ' A' ' 1' ' ' GLY . 1.8 ttt -61.84 -25.46 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.109 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -74.44 -30.95 62.1 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.256 -0.903 . . . . 0.0 109.23 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.808 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.4 m -79.16 -21.42 46.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.333 -0.855 . . . . 0.0 108.914 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -80.44 -37.92 31.08 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.531 HG13 ' N ' ' A' ' 10' ' ' SER . 35.8 pt -67.23 -37.47 79.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.531 ' N ' HG13 ' A' ' 9' ' ' ILE . 10.1 m -67.37 -38.57 84.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.355 -0.841 . . . . 0.0 109.012 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.808 HG23 ' O ' ' A' ' 7' ' ' THR . 82.3 t -59.25 -39.23 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.319 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.77 -45.26 94.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.11 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.815 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -66.34 -25.95 67.06 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.366 -0.833 . . . . 0.0 109.135 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -50.2 -72.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.497 -0.752 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -58.62 -36.19 73.68 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.144 -0.972 . . . . 0.0 109.425 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.59 -38.18 20.02 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 109.654 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.736 HG12 HD21 ' A' ' 21' ' ' LEU . 44.5 t -80.63 -36.05 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.951 . . . . 0.0 109.686 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.77 -56.83 7.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 23' ' ' SER . 2.9 pp -60.53 -29.45 69.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.08 -1.013 . . . . 0.0 108.697 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.59 -30.29 71.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.547 -0.721 . . . . 0.0 109.19 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 17' ' ' VAL . 2.0 mt -71.28 -51.11 26.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.36 -0.838 . . . . 0.0 108.957 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.1 p -73.91 -5.27 40.11 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.37 -0.831 . . . . 0.0 109.564 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -84.97 -61.95 1.65 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.932 . . . . 0.0 109.727 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ARG . 3.5 tt0 -74.57 -34.87 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.146 -0.971 . . . . 0.0 109.2 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.51 ' CG ' ' O ' ' A' ' 25' ' ' ARG . 2.6 ttt180 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.684 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.701 ' HA3' ' HB2' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.529 4.867 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 58.46 -148.23 0.48 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -1.135 . . . . 0.0 109.543 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -49.74 -40.12 39.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.166 -0.959 . . . . 0.0 109.475 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -46.12 81.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.261 -0.899 . . . . 0.0 109.299 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -68.05 -20.26 64.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 109.31 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.446 ' O ' ' CG1' ' A' ' 9' ' ' ILE . 1.4 m -73.57 -47.59 39.39 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.329 -0.857 . . . . 0.0 109.323 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 11' ' ' VAL . 1.7 p -76.72 -16.99 59.35 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.229 -0.919 . . . . 0.0 108.68 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' O ' ' CG ' ' A' ' 12' ' ' LEU . . . -83.5 -31.05 26.69 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.897 HG23 ' O ' ' A' ' 5' ' ' MET . 17.1 pt -76.19 -34.44 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.396 -0.815 . . . . 0.0 108.918 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.71 -56.38 7.38 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 108.692 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 7' ' ' THR . 38.2 t -60.76 -25.59 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.134 -0.979 . . . . 0.0 108.497 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 9' ' ' ILE . 5.1 mt -61.16 -46.18 91.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -0.832 . . . . 0.0 109.116 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.59 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.0 -24.28 60.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.47 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -64.72 0.82 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.312 -0.867 . . . . 0.0 109.717 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -46.33 87.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 109.823 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -49.55 -26.85 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.099 -1.001 . . . . 0.0 109.204 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' LEU . 48.7 t -85.19 -34.63 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 109.559 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -61.8 2.07 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.45 -31.75 70.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -0.908 . . . . 0.0 109.111 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 6.1 tp -69.09 -27.15 65.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.298 -0.876 . . . . 0.0 109.053 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.6 tp -71.36 -51.87 21.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.41 -0.806 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 t -71.75 -13.81 61.82 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.338 -0.851 . . . . 0.0 109.173 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.81 -41.28 45.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.363 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.59 -24.73 41.84 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.329 -0.857 . . . . 0.0 108.838 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.564 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.529 4.86 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.463 ' O ' ' O ' ' A' ' 1' ' ' GLY . 42.0 m 57.38 159.87 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.332 -1.099 . . . . 0.0 109.485 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.27 -16.92 15.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.923 . . . . 0.0 109.531 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.822 ' O ' HG22 ' A' ' 7' ' ' THR . 1.8 mptp? -75.52 -67.07 0.7 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.157 -0.965 . . . . 0.0 109.2 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.498 ' HB3' ' HA3' ' A' ' 1' ' ' GLY . 2.4 ttt -56.53 -19.25 14.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.212 -0.93 . . . . 0.0 109.124 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.46 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.3 t -82.88 -33.86 26.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.369 -0.832 . . . . 0.0 109.248 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.822 HG22 ' O ' ' A' ' 4' ' ' LYS . 14.6 t -77.13 -17.38 58.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.289 -0.882 . . . . 0.0 108.631 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.07 -38.89 24.23 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.501 ' O ' HD13 ' A' ' 13' ' ' LEU . 33.9 pt -69.15 -30.9 47.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 9' ' ' ILE . 75.4 m -67.48 -54.07 23.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.387 -0.821 . . . . 0.0 109.132 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 57.6 t -52.58 -35.34 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.177 -0.952 . . . . 0.0 108.971 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.489 ' O ' ' HG2' ' A' ' 15' ' ' GLN . 6.5 mt -58.61 -56.3 23.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 0.0 109.184 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.535 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.2 mp -54.75 -29.58 54.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.178 -0.951 . . . . 0.0 109.222 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -57.08 -69.48 0.16 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 4.3 pt20 -52.17 -24.55 7.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.156 -0.965 . . . . 0.0 109.314 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -66.65 -44.86 80.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.46 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.62 -40.94 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 109.365 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 22' ' ' THR . 62.9 t80 -54.46 -62.52 1.6 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.237 -0.915 . . . . 0.0 109.36 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.589 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.0 pp -64.23 -18.12 64.23 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.332 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.59 -35.3 70.47 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.285 -0.885 . . . . 0.0 109.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.437 HD11 ' CZ ' ' A' ' 25' ' ' ARG . 38.7 tp -77.13 -42.17 38.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.485 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 18' ' ' PHE . 2.2 p -66.73 -25.5 66.54 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.882 . . . . 0.0 109.577 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.6 OUTLIER -85.09 -33.8 22.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.343 -0.848 . . . . 0.0 109.814 -179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.03 -15.68 57.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.161 -0.962 . . . . 0.0 109.716 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CZ ' HD11 ' A' ' 21' ' ' LEU . 3.0 tpp180 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.543 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.451 ' HA2' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 1 N--CA 1.528 4.815 0 N-CA-C 119.309 2.484 . . . . 0.0 119.309 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m -57.56 -45.23 85.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.334 -1.098 . . . . 0.0 109.561 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -56.89 -37.05 70.86 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.286 -0.883 . . . . 0.0 109.572 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' HG2' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -65.44 -56.28 13.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.255 -0.903 . . . . 0.0 109.297 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -18.85 24.3 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.245 -0.909 . . . . 0.0 109.184 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 10' ' ' SER . 23.6 t -85.09 -31.33 23.42 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 109.406 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.782 ' O ' HG23 ' A' ' 11' ' ' VAL . 48.1 m -81.44 -15.46 55.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 109.154 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.08 -45.9 11.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.551 ' HA ' HD12 ' A' ' 12' ' ' LEU . 1.2 pt -68.85 -27.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.517 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -75.45 -37.99 59.98 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.294 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 7' ' ' THR . 39.8 t -59.85 -39.54 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.299 -0.876 . . . . 0.0 108.964 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 9' ' ' ILE . 63.4 mt -53.28 -43.03 67.14 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.315 -0.866 . . . . 0.0 109.517 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.657 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.1 mm? -71.28 -39.19 71.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.903 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.23 -51.8 41.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.234 -0.916 . . . . 0.0 109.527 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -39.44 85.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 109.582 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.01 -41.1 59.56 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.204 -0.935 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 82.2 t -81.64 -26.42 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 0.0 109.431 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.25 -65.22 0.71 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.458 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.472 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 3.6 pp -53.57 -19.5 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.862 . . . . 0.0 109.649 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.6 -53.27 12.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.73 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.59 ' C ' HD12 ' A' ' 21' ' ' LEU . 2.8 pp -65.7 -30.99 71.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 109.648 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 32.5 p -71.43 -35.58 71.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 109.495 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -66.9 -53.98 26.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.256 -0.902 . . . . 0.0 109.523 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.437 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -66.39 -18.91 65.63 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.466 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.837 0 N-CA-C 119.406 2.523 . . . . 0.0 119.406 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 t -75.82 -83.67 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 109.592 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -47.67 -29.35 2.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.178 -0.951 . . . . 0.0 109.43 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -63.73 -58.6 6.36 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.309 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.489 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -55.52 -24.5 32.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 109.335 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.491 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.4 t -71.19 -36.76 72.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.39 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -16.94 57.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 108.826 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.499 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -84.04 -35.3 23.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.526 HG13 ' N ' ' A' ' 10' ' ' SER . 12.0 pt -75.88 -29.61 20.22 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.412 -0.805 . . . . 0.0 108.954 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.526 ' N ' HG13 ' A' ' 9' ' ' ILE . 52.9 p -73.24 -47.45 43.08 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.233 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -63.19 -31.86 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.194 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 8' ' ' ALA . 6.8 mt -66.43 -49.74 65.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.29 -0.881 . . . . 0.0 109.375 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.3 mp -62.81 -25.58 68.32 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.213 -0.93 . . . . 0.0 109.173 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -59.47 -74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.442 -0.786 . . . . 0.0 109.561 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.69 -11.76 55.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 12' ' ' LEU . . . -67.31 -69.1 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.189 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.22 -28.76 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.874 . . . . 0.0 109.091 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -58.7 -68.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.41 -0.807 . . . . 0.0 109.287 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.724 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.7 pp -53.9 -20.48 6.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.286 -0.883 . . . . 0.0 109.275 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.81 -47.51 77.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.051 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.558 ' N ' HD23 ' A' ' 21' ' ' LEU . 1.9 mt -64.76 -41.59 95.78 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.0 m -62.8 -27.39 69.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.409 -0.807 . . . . 0.0 109.048 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -44.83 67.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.374 -0.829 . . . . 0.0 109.234 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' OE1' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -70.41 -16.67 62.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.302 -0.874 . . . . 0.0 109.064 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 117.963 -1.017 . . . . 0.0 109.42 -179.814 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.804 0 N-CA-C 119.392 2.517 . . . . 0.0 119.392 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 p -78.06 -50.05 12.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -1.152 . . . . 0.0 109.612 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -60.97 -38.0 84.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.378 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -69.76 -48.18 60.25 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.226 -0.921 . . . . 0.0 109.213 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.747 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -65.98 -17.61 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.31 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.483 ' HA ' HG12 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -80.07 -35.91 36.33 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.304 -0.873 . . . . 0.0 109.177 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 90.8 m -80.61 -21.28 41.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.318 -0.863 . . . . 0.0 108.917 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.04 -37.94 19.77 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.356 -0.84 . . . . 0.0 108.816 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 5' ' ' MET . 1.3 pp -71.12 -31.42 44.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 C-N-CA 119.712 -0.795 . . . . 0.0 108.916 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.76 -55.85 6.87 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.196 -0.94 . . . . 0.0 108.774 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.0 t -53.36 -26.27 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.235 -0.916 . . . . 0.0 108.671 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 12' ' ' LEU . 12.2 mt -64.53 -59.73 3.97 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.391 -0.818 . . . . 0.0 108.953 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.525 HD22 ' N ' ' A' ' 13' ' ' LEU . 4.0 mm? -48.88 -29.7 4.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.178 -0.951 . . . . 0.0 108.708 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -62.59 -56.62 16.17 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.482 -0.761 . . . . 0.0 109.307 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -52.06 -33.52 39.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.244 -0.91 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.2 91.45 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.228 -0.92 . . . . 0.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.462 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 56.0 t -59.23 -41.27 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.247 -0.908 . . . . 0.0 109.5 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.418 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.0 t80 -61.27 -56.79 16.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.126 -0.984 . . . . 0.0 109.225 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -15.7 42.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.913 . . . . 0.0 109.318 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.462 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 14.1 tp -70.37 -50.91 34.03 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.916 . . . . 0.0 109.161 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 22' ' ' THR . 1.7 pp -67.49 -27.63 67.17 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.214 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.486 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 63.5 m -82.41 -20.52 36.91 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.895 . . . . 0.0 109.507 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.9 m -82.21 -55.33 4.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 109.516 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -78.04 -26.95 48.65 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.14 -0.975 . . . . 0.0 109.145 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.491 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.942 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.79 ' HA2' ' CG ' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.528 4.803 0 N-CA-C 119.561 2.585 . . . . 0.0 119.561 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.437 ' CB ' ' O ' ' A' ' 1' ' ' GLY . 0.7 OUTLIER 70.9 -176.53 0.2 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.345 -1.091 . . . . 0.0 110.006 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -47.17 -30.1 2.7 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.31 -0.869 . . . . 0.0 109.626 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -59.0 6.15 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.938 . . . . 0.0 109.381 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.79 ' CG ' ' HA2' ' A' ' 1' ' ' GLY . 0.0 OUTLIER -53.89 -29.93 43.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.493 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 9' ' ' ILE . 8.4 t -70.62 -36.33 73.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.121 -0.987 . . . . 0.0 109.456 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 11' ' ' VAL . 16.8 m -80.1 -17.48 52.48 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.287 -0.883 . . . . 0.0 109.074 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -85.25 -32.74 22.42 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 12' ' ' LEU . 24.3 pt -72.87 -43.24 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.517 -0.739 . . . . 0.0 109.3 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.508 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.35 -49.46 49.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.256 -0.903 . . . . 0.0 108.883 179.669 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 7' ' ' THR . 77.6 t -61.32 -23.57 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.256 -0.902 . . . . 0.0 108.932 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' ALA . 3.1 mt -65.46 -50.08 66.69 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.287 -0.883 . . . . 0.0 109.283 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.831 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.64 -28.21 69.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 108.96 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -77.6 -25.41 49.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.519 ' CA ' ' OE1' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -79.52 -27.58 41.35 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.279 -0.888 . . . . 0.0 109.483 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.12 -47.98 77.07 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.901 . . . . 0.0 109.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.1 t -83.97 -30.07 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.729 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER -56.95 -62.01 2.04 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.121 -0.987 . . . . 0.0 109.603 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.433 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 87.4 mt -59.12 -28.36 66.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.541 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 20' ' ' LEU . 5.4 tp -55.19 -56.25 22.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.94 . . . . 0.0 109.258 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 tp -60.04 -54.42 46.19 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.244 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 82.1 p -47.31 -28.07 1.84 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.29 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.2 t -71.04 -51.29 26.15 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.369 -0.832 . . . . 0.0 109.365 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -66.73 -9.89 41.33 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.33 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.479 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.461 ' O ' ' HB2' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.528 4.822 0 N-CA-C 119.341 2.497 . . . . 0.0 119.341 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.461 ' HB2' ' O ' ' A' ' 1' ' ' GLY . 51.0 m 64.05 171.92 0.18 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.315 -1.109 . . . . 0.0 109.497 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -59.37 -22.33 61.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.358 -0.839 . . . . 0.0 109.625 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -58.2 7.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.162 -0.961 . . . . 0.0 109.433 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.81 -21.2 66.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.151 -0.968 . . . . 0.0 109.507 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 9' ' ' ILE . 5.6 t -73.83 -36.75 64.96 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.29 -0.882 . . . . 0.0 109.409 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.602 ' O ' HG23 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -80.7 -18.43 47.9 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.271 -0.893 . . . . 0.0 108.835 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.75 -30.92 28.65 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 5' ' ' MET . 33.3 pt -75.16 -39.96 43.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.532 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.3 OUTLIER -67.89 -36.61 80.53 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.312 -0.867 . . . . 0.0 108.683 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 7' ' ' THR . 21.4 t -60.02 -45.93 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.03 -55.63 16.54 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.282 -0.886 . . . . 0.0 109.136 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.9 mm? -57.29 -31.9 66.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.162 -0.962 . . . . 0.0 108.937 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -54.68 -57.1 12.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.295 -0.878 . . . . 0.0 108.888 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -59.19 -31.75 69.3 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.319 -0.863 . . . . 0.0 108.92 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -59.54 -36.57 76.39 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.307 -0.871 . . . . 0.0 108.933 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.7 t -78.42 -32.55 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.3 -0.875 . . . . 0.0 108.855 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.0 t80 -57.97 -59.83 4.66 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.381 -0.824 . . . . 0.0 108.947 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.73 -21.85 4.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.28 -0.888 . . . . 0.0 108.834 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 20' ' ' LEU . 3.8 tt -66.51 -54.78 20.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.404 -0.81 . . . . 0.0 109.273 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.45 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.9 pp -64.49 -25.58 68.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.269 -0.894 . . . . 0.0 109.096 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -63.2 -49.3 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.319 -0.863 . . . . 0.0 109.348 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -47.84 66.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.242 -0.911 . . . . 0.0 109.159 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -71.53 -5.1 30.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.878 . . . . 0.0 109.389 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' LEU . 2.3 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.211 0.529 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.36 -61.65 1.89 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.12 -17.93 63.93 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.198 -0.938 . . . . 0.0 109.177 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.6 t -78.25 -33.68 49.53 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.293 -0.879 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 p -83.98 -18.06 38.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.337 -0.852 . . . . 0.0 109.322 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.68 -40.82 15.74 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.28 -0.888 . . . . 0.0 108.733 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.526 ' O ' ' CD2' ' A' ' 13' ' ' LEU . 1.4 pp -75.09 -30.75 23.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 O-C-N 121.392 -0.818 . . . . 0.0 109.46 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.5 OUTLIER -77.64 -46.97 20.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.158 -0.963 . . . . 0.0 108.915 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 t -61.33 -27.44 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.282 -0.886 . . . . 0.0 108.833 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 12' ' ' LEU . 8.8 mt -60.7 -47.46 86.16 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 0.0 109.425 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -71.15 -38.57 72.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.116 -0.99 . . . . 0.0 109.245 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -46.24 -50.74 15.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.392 -0.817 . . . . 0.0 109.603 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.508 ' HA ' ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -69.13 -47.41 65.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.234 -0.916 . . . . 0.0 109.729 -179.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 15' ' ' GLN . . . -41.89 -52.57 4.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.395 -0.815 . . . . 0.0 110.127 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.7 t -82.58 -23.68 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.131 -0.981 . . . . 0.0 109.919 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.508 ' HB2' ' HA ' ' A' ' 15' ' ' GLN . 2.4 t80 -53.4 -63.44 1.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.141 -0.974 . . . . 0.0 109.439 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 31.9 mt -61.23 -30.44 70.44 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 109.387 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.451 ' HA ' HD12 ' A' ' 20' ' ' LEU . 14.4 tp -61.13 -32.28 71.98 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.0 109.359 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 11.7 tp -80.62 -60.14 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.288 -0.882 . . . . 0.0 109.562 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.9 p -45.89 -34.36 3.8 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -0.863 . . . . 0.0 109.834 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.49 -47.76 31.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.0 109.702 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -83.45 10.99 7.58 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.235 -0.915 . . . . 0.0 109.596 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 4.0 mmt-85 . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.385 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 121.273 0.559 . . . . 0.0 109.534 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.78 -53.25 10.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 0.0 109.514 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.618 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.67 -22.57 63.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.249 -0.907 . . . . 0.0 109.641 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.418 ' O ' HG13 ' A' ' 9' ' ' ILE . 47.0 t -80.43 -32.39 37.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.172 -0.955 . . . . 0.0 109.678 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.6 p -82.18 -20.9 36.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.326 -0.859 . . . . 0.0 109.174 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.27 -40.93 17.4 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.618 HG23 ' O ' ' A' ' 5' ' ' MET . 2.5 pp -69.04 -32.78 55.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 73.5 m -67.85 -51.43 48.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.476 -0.765 . . . . 0.0 109.199 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.6 t -54.67 -34.36 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -0.918 . . . . 0.0 109.205 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 12' ' ' LEU . 51.5 mt -61.53 -46.78 88.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 0.0 109.493 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.817 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -71.64 -21.31 61.84 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.203 -0.936 . . . . 0.0 109.095 -179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -64.34 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.353 -0.842 . . . . 0.0 109.714 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -72.53 -22.96 60.94 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.163 -0.961 . . . . 0.0 109.704 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.424 ' HB3' ' HA ' ' A' ' 13' ' ' LEU . . . -72.79 -72.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 50.7 t -55.58 -26.98 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 109.784 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.489 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 2.1 t80 -63.28 -62.91 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.317 -0.864 . . . . 0.0 109.772 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' CB ' ' A' ' 23' ' ' SER . 83.7 mt -68.74 -16.84 63.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 110.015 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 20' ' ' LEU . 0.3 OUTLIER -67.69 -51.92 43.93 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.052 -1.03 . . . . 0.0 109.24 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.4 tp -66.75 -46.55 75.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 0.0 109.246 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -14.71 63.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -0.927 . . . . 0.0 109.215 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.444 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -78.65 -67.82 0.71 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -78.09 -3.44 42.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.311 -0.868 . . . . 0.0 109.674 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.484 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.57 -65.67 0.7 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.301 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.479 ' O ' HG23 ' A' ' 9' ' ' ILE . 1.8 ttt -61.84 -25.46 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.109 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -74.44 -30.95 62.1 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.256 -0.903 . . . . 0.0 109.23 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.808 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.4 m -79.16 -21.42 46.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.333 -0.855 . . . . 0.0 108.914 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -80.44 -37.92 31.08 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.531 HG13 ' N ' ' A' ' 10' ' ' SER . 35.8 pt -67.23 -37.47 79.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.531 ' N ' HG13 ' A' ' 9' ' ' ILE . 10.1 m -67.37 -38.57 84.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.355 -0.841 . . . . 0.0 109.012 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.808 HG23 ' O ' ' A' ' 7' ' ' THR . 82.3 t -59.25 -39.23 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.319 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.77 -45.26 94.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.11 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.815 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -66.34 -25.95 67.06 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.366 -0.833 . . . . 0.0 109.135 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -50.2 -72.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.497 -0.752 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -58.62 -36.19 73.68 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.144 -0.972 . . . . 0.0 109.425 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.59 -38.18 20.02 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 109.654 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.736 HG12 HD21 ' A' ' 21' ' ' LEU . 44.5 t -80.63 -36.05 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.951 . . . . 0.0 109.686 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.77 -56.83 7.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 23' ' ' SER . 2.9 pp -60.53 -29.45 69.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.08 -1.013 . . . . 0.0 108.697 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.59 -30.29 71.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.547 -0.721 . . . . 0.0 109.19 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 17' ' ' VAL . 2.0 mt -71.28 -51.11 26.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.36 -0.838 . . . . 0.0 108.957 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.1 p -73.91 -5.27 40.11 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.37 -0.831 . . . . 0.0 109.564 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -84.97 -61.95 1.65 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.932 . . . . 0.0 109.727 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ARG . 3.5 tt0 -74.57 -34.87 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.146 -0.971 . . . . 0.0 109.2 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.51 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 2.6 ttt180 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.684 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 121.3 0.571 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -46.12 81.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.261 -0.899 . . . . 0.0 109.299 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -68.05 -20.26 64.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 109.31 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.446 ' O ' ' CG1' ' A' ' 9' ' ' ILE . 1.4 m -73.57 -47.59 39.39 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.329 -0.857 . . . . 0.0 109.323 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 11' ' ' VAL . 1.7 p -76.72 -16.99 59.35 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.229 -0.919 . . . . 0.0 108.68 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' O ' ' CG ' ' A' ' 12' ' ' LEU . . . -83.5 -31.05 26.69 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.897 HG23 ' O ' ' A' ' 5' ' ' MET . 17.1 pt -76.19 -34.44 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.396 -0.815 . . . . 0.0 108.918 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.71 -56.38 7.38 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 108.692 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 7' ' ' THR . 38.2 t -60.76 -25.59 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.134 -0.979 . . . . 0.0 108.497 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 9' ' ' ILE . 5.1 mt -61.16 -46.18 91.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -0.832 . . . . 0.0 109.116 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.59 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.0 -24.28 60.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.47 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -64.72 0.82 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.312 -0.867 . . . . 0.0 109.717 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -46.33 87.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 109.823 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -49.55 -26.85 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.099 -1.001 . . . . 0.0 109.204 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' LEU . 48.7 t -85.19 -34.63 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 109.559 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -61.8 2.07 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.45 -31.75 70.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -0.908 . . . . 0.0 109.111 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 6.1 tp -69.09 -27.15 65.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.298 -0.876 . . . . 0.0 109.053 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.6 tp -71.36 -51.87 21.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.41 -0.806 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 t -71.75 -13.81 61.82 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.338 -0.851 . . . . 0.0 109.173 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.81 -41.28 45.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.363 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.59 -24.73 41.84 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.329 -0.857 . . . . 0.0 108.838 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.564 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.281 0.562 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.822 ' O ' HG22 ' A' ' 7' ' ' THR . 1.8 mptp? -75.52 -67.07 0.7 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.157 -0.965 . . . . 0.0 109.2 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.479 ' O ' HG23 ' A' ' 9' ' ' ILE . 2.4 ttt -56.53 -19.25 14.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.212 -0.93 . . . . 0.0 109.124 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.46 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.3 t -82.88 -33.86 26.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.369 -0.832 . . . . 0.0 109.248 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.822 HG22 ' O ' ' A' ' 4' ' ' LYS . 14.6 t -77.13 -17.38 58.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.289 -0.882 . . . . 0.0 108.631 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.07 -38.89 24.23 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.501 ' O ' HD13 ' A' ' 13' ' ' LEU . 33.9 pt -69.15 -30.9 47.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 9' ' ' ILE . 75.4 m -67.48 -54.07 23.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.387 -0.821 . . . . 0.0 109.132 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 57.6 t -52.58 -35.34 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.177 -0.952 . . . . 0.0 108.971 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.489 ' O ' ' HG2' ' A' ' 15' ' ' GLN . 6.5 mt -58.61 -56.3 23.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 0.0 109.184 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.535 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.2 mp -54.75 -29.58 54.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.178 -0.951 . . . . 0.0 109.222 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -57.08 -69.48 0.16 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 4.3 pt20 -52.17 -24.55 7.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.156 -0.965 . . . . 0.0 109.314 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -66.65 -44.86 80.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.46 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.62 -40.94 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 109.365 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 22' ' ' THR . 62.9 t80 -54.46 -62.52 1.6 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.237 -0.915 . . . . 0.0 109.36 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.589 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.0 pp -64.23 -18.12 64.23 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.332 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.59 -35.3 70.47 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.285 -0.885 . . . . 0.0 109.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.437 HD11 ' CZ ' ' A' ' 25' ' ' ARG . 38.7 tp -77.13 -42.17 38.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.485 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 18' ' ' PHE . 2.2 p -66.73 -25.5 66.54 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.882 . . . . 0.0 109.577 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.6 OUTLIER -85.09 -33.8 22.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.343 -0.848 . . . . 0.0 109.814 -179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.03 -15.68 57.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.161 -0.962 . . . . 0.0 109.716 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CZ ' HD11 ' A' ' 21' ' ' LEU . 3.0 tpp180 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.543 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -65.44 -56.28 13.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.255 -0.903 . . . . 0.0 109.297 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -18.85 24.3 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.245 -0.909 . . . . 0.0 109.184 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 10' ' ' SER . 23.6 t -85.09 -31.33 23.42 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 109.406 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.782 ' O ' HG23 ' A' ' 11' ' ' VAL . 48.1 m -81.44 -15.46 55.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 109.154 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.08 -45.9 11.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.551 ' HA ' HD12 ' A' ' 12' ' ' LEU . 1.2 pt -68.85 -27.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.517 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -75.45 -37.99 59.98 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 7' ' ' THR . 39.8 t -59.85 -39.54 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.299 -0.876 . . . . 0.0 108.964 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 9' ' ' ILE . 63.4 mt -53.28 -43.03 67.14 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.315 -0.866 . . . . 0.0 109.517 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.657 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.1 mm? -71.28 -39.19 71.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.903 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.23 -51.8 41.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.234 -0.916 . . . . 0.0 109.527 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -39.44 85.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 109.582 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.01 -41.1 59.56 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.204 -0.935 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 82.2 t -81.64 -26.42 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 0.0 109.431 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.25 -65.22 0.71 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.458 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.472 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 3.6 pp -53.57 -19.5 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.862 . . . . 0.0 109.649 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.6 -53.27 12.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.73 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.59 ' C ' HD12 ' A' ' 21' ' ' LEU . 2.8 pp -65.7 -30.99 71.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 109.648 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 32.5 p -71.43 -35.58 71.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 109.495 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -66.9 -53.98 26.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.256 -0.902 . . . . 0.0 109.523 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.437 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -66.39 -18.91 65.63 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.466 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -63.73 -58.6 6.36 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.309 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.489 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -55.52 -24.5 32.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 109.335 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.491 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.4 t -71.19 -36.76 72.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.39 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -16.94 57.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 108.826 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.499 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -84.04 -35.3 23.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.526 HG13 ' N ' ' A' ' 10' ' ' SER . 12.0 pt -75.88 -29.61 20.22 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.412 -0.805 . . . . 0.0 108.954 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.526 ' N ' HG13 ' A' ' 9' ' ' ILE . 52.9 p -73.24 -47.45 43.08 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.233 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -63.19 -31.86 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.194 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 8' ' ' ALA . 6.8 mt -66.43 -49.74 65.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.29 -0.881 . . . . 0.0 109.375 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.3 mp -62.81 -25.58 68.32 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.213 -0.93 . . . . 0.0 109.173 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -59.47 -74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.442 -0.786 . . . . 0.0 109.561 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.69 -11.76 55.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 12' ' ' LEU . . . -67.31 -69.1 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.189 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.22 -28.76 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.874 . . . . 0.0 109.091 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -58.7 -68.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.41 -0.807 . . . . 0.0 109.287 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.724 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.7 pp -53.9 -20.48 6.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.286 -0.883 . . . . 0.0 109.275 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.81 -47.51 77.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.051 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.558 ' N ' HD23 ' A' ' 21' ' ' LEU . 1.9 mt -64.76 -41.59 95.78 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.0 m -62.8 -27.39 69.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.409 -0.807 . . . . 0.0 109.048 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -44.83 67.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.374 -0.829 . . . . 0.0 109.234 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' OE1' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -70.41 -16.67 62.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.302 -0.874 . . . . 0.0 109.064 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 117.963 -1.017 . . . . 0.0 109.42 -179.814 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -69.76 -48.18 60.25 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.226 -0.921 . . . . 0.0 109.213 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.747 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -65.98 -17.61 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.31 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.483 ' HA ' HG12 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -80.07 -35.91 36.33 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.304 -0.873 . . . . 0.0 109.177 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 90.8 m -80.61 -21.28 41.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.318 -0.863 . . . . 0.0 108.917 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.04 -37.94 19.77 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.356 -0.84 . . . . 0.0 108.816 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 5' ' ' MET . 1.3 pp -71.12 -31.42 44.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 C-N-CA 119.712 -0.795 . . . . 0.0 108.916 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.76 -55.85 6.87 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.196 -0.94 . . . . 0.0 108.774 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.0 t -53.36 -26.27 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.235 -0.916 . . . . 0.0 108.671 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 12' ' ' LEU . 12.2 mt -64.53 -59.73 3.97 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.391 -0.818 . . . . 0.0 108.953 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.525 HD22 ' N ' ' A' ' 13' ' ' LEU . 4.0 mm? -48.88 -29.7 4.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.178 -0.951 . . . . 0.0 108.708 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -62.59 -56.62 16.17 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.482 -0.761 . . . . 0.0 109.307 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -52.06 -33.52 39.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.244 -0.91 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.2 91.45 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.228 -0.92 . . . . 0.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.462 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 56.0 t -59.23 -41.27 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.247 -0.908 . . . . 0.0 109.5 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.418 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.0 t80 -61.27 -56.79 16.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.126 -0.984 . . . . 0.0 109.225 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -15.7 42.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.913 . . . . 0.0 109.318 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.462 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 14.1 tp -70.37 -50.91 34.03 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.916 . . . . 0.0 109.161 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 22' ' ' THR . 1.7 pp -67.49 -27.63 67.17 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.214 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.486 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 63.5 m -82.41 -20.52 36.91 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.895 . . . . 0.0 109.507 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.9 m -82.21 -55.33 4.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 109.516 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -78.04 -26.95 48.65 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.14 -0.975 . . . . 0.0 109.145 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.491 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.942 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 121.215 0.531 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -59.0 6.15 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.938 . . . . 0.0 109.381 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.554 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -53.89 -29.93 43.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.493 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 9' ' ' ILE . 8.4 t -70.62 -36.33 73.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.121 -0.987 . . . . 0.0 109.456 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 11' ' ' VAL . 16.8 m -80.1 -17.48 52.48 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.287 -0.883 . . . . 0.0 109.074 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -85.25 -32.74 22.42 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 12' ' ' LEU . 24.3 pt -72.87 -43.24 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.517 -0.739 . . . . 0.0 109.3 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.508 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.35 -49.46 49.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.256 -0.903 . . . . 0.0 108.883 179.669 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 7' ' ' THR . 77.6 t -61.32 -23.57 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.256 -0.902 . . . . 0.0 108.932 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' ALA . 3.1 mt -65.46 -50.08 66.69 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.287 -0.883 . . . . 0.0 109.283 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.831 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.64 -28.21 69.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 108.96 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -77.6 -25.41 49.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.519 ' CA ' ' OE1' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -79.52 -27.58 41.35 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.279 -0.888 . . . . 0.0 109.483 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.12 -47.98 77.07 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.901 . . . . 0.0 109.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.1 t -83.97 -30.07 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.729 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER -56.95 -62.01 2.04 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.121 -0.987 . . . . 0.0 109.603 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.433 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 87.4 mt -59.12 -28.36 66.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.541 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 20' ' ' LEU . 5.4 tp -55.19 -56.25 22.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.94 . . . . 0.0 109.258 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 tp -60.04 -54.42 46.19 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.244 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 82.1 p -47.31 -28.07 1.84 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.29 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.2 t -71.04 -51.29 26.15 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.369 -0.832 . . . . 0.0 109.365 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -66.73 -9.89 41.33 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.33 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.479 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.278 0.561 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -58.2 7.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.162 -0.961 . . . . 0.0 109.433 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.81 -21.2 66.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.151 -0.968 . . . . 0.0 109.507 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 9' ' ' ILE . 5.6 t -73.83 -36.75 64.96 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.29 -0.882 . . . . 0.0 109.409 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.602 ' O ' HG23 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -80.7 -18.43 47.9 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.271 -0.893 . . . . 0.0 108.835 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.75 -30.92 28.65 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 5' ' ' MET . 33.3 pt -75.16 -39.96 43.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.532 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.3 OUTLIER -67.89 -36.61 80.53 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.312 -0.867 . . . . 0.0 108.683 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 7' ' ' THR . 21.4 t -60.02 -45.93 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.03 -55.63 16.54 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.282 -0.886 . . . . 0.0 109.136 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.9 mm? -57.29 -31.9 66.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.162 -0.962 . . . . 0.0 108.937 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -54.68 -57.1 12.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.295 -0.878 . . . . 0.0 108.888 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -59.19 -31.75 69.3 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.319 -0.863 . . . . 0.0 108.92 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -59.54 -36.57 76.39 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.307 -0.871 . . . . 0.0 108.933 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.7 t -78.42 -32.55 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.3 -0.875 . . . . 0.0 108.855 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.0 t80 -57.97 -59.83 4.66 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.381 -0.824 . . . . 0.0 108.947 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.73 -21.85 4.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.28 -0.888 . . . . 0.0 108.834 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 20' ' ' LEU . 3.8 tt -66.51 -54.78 20.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.404 -0.81 . . . . 0.0 109.273 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.45 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.9 pp -64.49 -25.58 68.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.269 -0.894 . . . . 0.0 109.096 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -63.2 -49.3 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.319 -0.863 . . . . 0.0 109.348 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -47.84 66.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.242 -0.911 . . . . 0.0 109.159 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -71.53 -5.1 30.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.878 . . . . 0.0 109.389 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' LEU . 2.3 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.53 4.903 0 N-CA-C 119.45 2.54 . . . . 0.0 119.45 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 67.55 172.84 0.27 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -1.123 . . . . 0.0 109.544 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.59 -19.44 48.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.214 -0.929 . . . . 0.0 109.608 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.36 -61.65 1.89 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.236 -0.915 . . . . 0.0 109.328 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.457 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.12 -17.93 63.93 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.198 -0.938 . . . . 0.0 109.177 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' SER . 6.6 t -78.25 -33.68 49.53 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.293 -0.879 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 p -83.98 -18.06 38.45 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.337 -0.852 . . . . 0.0 109.322 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.68 -40.82 15.74 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.28 -0.888 . . . . 0.0 108.733 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.526 ' O ' ' CD2' ' A' ' 13' ' ' LEU . 1.4 pp -75.09 -30.75 23.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.412 0 O-C-N 121.392 -0.818 . . . . 0.0 109.46 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.5 OUTLIER -77.64 -46.97 20.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.158 -0.963 . . . . 0.0 108.915 179.622 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.6 t -61.33 -27.44 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 O-C-N 121.282 -0.886 . . . . 0.0 108.833 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 12' ' ' LEU . 8.8 mt -60.7 -47.46 86.16 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.256 -0.903 . . . . 0.0 109.425 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.597 HD22 ' N ' ' A' ' 13' ' ' LEU . 2.5 mm? -71.15 -38.57 72.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.116 -0.99 . . . . 0.0 109.245 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -46.24 -50.74 15.56 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.392 -0.817 . . . . 0.0 109.603 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.508 ' HA ' ' HB2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -69.13 -47.41 65.14 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.234 -0.916 . . . . 0.0 109.729 -179.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.427 ' C ' ' O ' ' A' ' 15' ' ' GLN . . . -41.89 -52.57 4.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.395 -0.815 . . . . 0.0 110.127 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.7 t -82.58 -23.68 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.131 -0.981 . . . . 0.0 109.919 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.508 ' HB2' ' HA ' ' A' ' 15' ' ' GLN . 2.4 t80 -53.4 -63.44 1.15 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.141 -0.974 . . . . 0.0 109.439 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 31.9 mt -61.23 -30.44 70.44 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.325 -0.86 . . . . 0.0 109.387 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.451 ' HA ' HD12 ' A' ' 20' ' ' LEU . 14.4 tp -61.13 -32.28 71.98 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.245 -0.909 . . . . 0.0 109.359 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 11.7 tp -80.62 -60.14 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.288 -0.882 . . . . 0.0 109.562 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.9 p -45.89 -34.36 3.8 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.319 -0.863 . . . . 0.0 109.834 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.49 -47.76 31.28 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.211 -0.931 . . . . 0.0 109.702 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -83.45 10.99 7.58 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.235 -0.915 . . . . 0.0 109.596 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 4.0 mmt-85 . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.385 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.531 4.984 0 N-CA-C 119.526 2.571 . . . . 0.0 119.526 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 65.25 158.49 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.198 -1.177 . . . . 0.0 109.554 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -13.43 21.17 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.262 -0.899 . . . . 0.0 109.534 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.78 -53.25 10.72 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 0.0 109.514 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.618 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.67 -22.57 63.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.249 -0.907 . . . . 0.0 109.641 -179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.418 ' O ' HG13 ' A' ' 9' ' ' ILE . 47.0 t -80.43 -32.39 37.35 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.172 -0.955 . . . . 0.0 109.678 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.6 p -82.18 -20.9 36.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.326 -0.859 . . . . 0.0 109.174 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.27 -40.93 17.4 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.618 HG23 ' O ' ' A' ' 5' ' ' MET . 2.5 pp -69.04 -32.78 55.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 73.5 m -67.85 -51.43 48.45 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.476 -0.765 . . . . 0.0 109.199 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.6 t -54.67 -34.36 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.231 -0.918 . . . . 0.0 109.205 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 12' ' ' LEU . 51.5 mt -61.53 -46.78 88.5 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.23 -0.919 . . . . 0.0 109.493 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.817 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -71.64 -21.31 61.84 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.203 -0.936 . . . . 0.0 109.095 -179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -64.34 0.96 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.353 -0.842 . . . . 0.0 109.714 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -72.53 -22.96 60.94 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.163 -0.961 . . . . 0.0 109.704 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.424 ' HB3' ' HA ' ' A' ' 13' ' ' LEU . . . -72.79 -72.46 0.24 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 50.7 t -55.58 -26.98 20.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 109.784 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.489 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 2.1 t80 -63.28 -62.91 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.317 -0.864 . . . . 0.0 109.772 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' CB ' ' A' ' 23' ' ' SER . 83.7 mt -68.74 -16.84 63.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.271 -0.893 . . . . 0.0 110.015 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.633 ' O ' HD13 ' A' ' 20' ' ' LEU . 0.3 OUTLIER -67.69 -51.92 43.93 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.052 -1.03 . . . . 0.0 109.24 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.4 tp -66.75 -46.55 75.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.34 -0.85 . . . . 0.0 109.246 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -14.71 63.19 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.216 -0.927 . . . . 0.0 109.215 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.444 ' CB ' ' O ' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -78.65 -67.82 0.71 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.292 -0.88 . . . . 0.0 109.48 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -78.09 -3.44 42.33 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.311 -0.868 . . . . 0.0 109.674 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.008 -0.996 . . . . 0.0 109.484 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.493 ' HA3' ' HB3' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.528 4.832 0 N-CA-C 119.289 2.475 . . . . 0.0 119.289 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.411 ' O ' ' HB3' ' A' ' 6' ' ' SER . 1.9 t 67.47 -164.36 0.21 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.279 -1.13 . . . . 0.0 109.41 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.76 -14.18 62.65 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.22 -0.925 . . . . 0.0 109.267 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.57 -65.67 0.7 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.238 -0.914 . . . . 0.0 109.301 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.493 ' HB3' ' HA3' ' A' ' 1' ' ' GLY . 1.8 ttt -61.84 -25.46 67.54 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.167 -0.958 . . . . 0.0 109.109 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -74.44 -30.95 62.1 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.256 -0.903 . . . . 0.0 109.23 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.808 ' O ' HG23 ' A' ' 11' ' ' VAL . 98.4 m -79.16 -21.42 46.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.333 -0.855 . . . . 0.0 108.914 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -80.44 -37.92 31.08 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.531 HG13 ' N ' ' A' ' 10' ' ' SER . 35.8 pt -67.23 -37.47 79.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.531 ' N ' HG13 ' A' ' 9' ' ' ILE . 10.1 m -67.37 -38.57 84.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.355 -0.841 . . . . 0.0 109.012 179.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.808 HG23 ' O ' ' A' ' 7' ' ' THR . 82.3 t -59.25 -39.23 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.319 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.77 -45.26 94.66 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.1 -1.0 . . . . 0.0 109.11 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.815 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -66.34 -25.95 67.06 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.366 -0.833 . . . . 0.0 109.135 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -50.2 -72.88 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.497 -0.752 . . . . 0.0 109.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -58.62 -36.19 73.68 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.144 -0.972 . . . . 0.0 109.425 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.59 -38.18 20.02 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 109.654 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.736 HG12 HD21 ' A' ' 21' ' ' LEU . 44.5 t -80.63 -36.05 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.178 -0.951 . . . . 0.0 109.686 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -48.77 -56.83 7.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.285 -0.884 . . . . 0.0 109.703 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 23' ' ' SER . 2.9 pp -60.53 -29.45 69.13 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.08 -1.013 . . . . 0.0 108.697 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -65.59 -30.29 71.0 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.547 -0.721 . . . . 0.0 109.19 179.631 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.736 HD21 HG12 ' A' ' 17' ' ' VAL . 2.0 mt -71.28 -51.11 26.25 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.36 -0.838 . . . . 0.0 108.957 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.1 p -73.91 -5.27 40.11 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.37 -0.831 . . . . 0.0 109.564 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -84.97 -61.95 1.65 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.932 . . . . 0.0 109.727 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.448 ' O ' ' C ' ' A' ' 25' ' ' ARG . 3.5 tt0 -74.57 -34.87 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.146 -0.971 . . . . 0.0 109.2 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.51 ' CG ' ' O ' ' A' ' 25' ' ' ARG . 2.6 ttt180 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.684 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.701 ' HA3' ' HB2' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.529 4.867 0 N-CA-C 119.43 2.532 . . . . 0.0 119.43 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m 58.46 -148.23 0.48 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -1.135 . . . . 0.0 109.543 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -49.74 -40.12 39.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.166 -0.959 . . . . 0.0 109.475 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -46.12 81.81 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.261 -0.899 . . . . 0.0 109.299 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.897 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -68.05 -20.26 64.96 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 109.31 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.446 ' O ' ' CG1' ' A' ' 9' ' ' ILE . 1.4 m -73.57 -47.59 39.39 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.329 -0.857 . . . . 0.0 109.323 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.426 ' O ' HG23 ' A' ' 11' ' ' VAL . 1.7 p -76.72 -16.99 59.35 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.229 -0.919 . . . . 0.0 108.68 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' O ' ' CG ' ' A' ' 12' ' ' LEU . . . -83.5 -31.05 26.69 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.897 HG23 ' O ' ' A' ' 5' ' ' MET . 17.1 pt -76.19 -34.44 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.396 -0.815 . . . . 0.0 108.918 179.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -69.71 -56.38 7.38 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.25 -0.906 . . . . 0.0 108.692 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 7' ' ' THR . 38.2 t -60.76 -25.59 35.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.134 -0.979 . . . . 0.0 108.497 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 9' ' ' ILE . 5.1 mt -61.16 -46.18 91.6 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.368 -0.832 . . . . 0.0 109.116 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.59 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.0 -24.28 60.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.317 -0.864 . . . . 0.0 109.47 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -64.72 0.82 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.312 -0.867 . . . . 0.0 109.717 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -46.33 87.31 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 109.823 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 20' ' ' LEU . . . -49.55 -26.85 3.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.099 -1.001 . . . . 0.0 109.204 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 13' ' ' LEU . 48.7 t -85.19 -34.63 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 109.559 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -61.8 2.07 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.437 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.45 -31.75 70.73 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.247 -0.908 . . . . 0.0 109.111 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 16' ' ' ALA . 6.1 tp -69.09 -27.15 65.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.298 -0.876 . . . . 0.0 109.053 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.6 tp -71.36 -51.87 21.84 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.41 -0.806 . . . . 0.0 109.212 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 t -71.75 -13.81 61.82 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.338 -0.851 . . . . 0.0 109.173 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.81 -41.28 45.04 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.911 . . . . 0.0 109.363 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.59 -24.73 41.84 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.329 -0.857 . . . . 0.0 108.838 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.564 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.529 4.86 0 N-CA-C 119.589 2.596 . . . . 0.0 119.589 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.463 ' O ' ' O ' ' A' ' 1' ' ' GLY . 42.0 m 57.38 159.87 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.332 -1.099 . . . . 0.0 109.485 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -58.27 -16.92 15.97 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.224 -0.923 . . . . 0.0 109.531 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.822 ' O ' HG22 ' A' ' 7' ' ' THR . 1.8 mptp? -75.52 -67.07 0.7 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.157 -0.965 . . . . 0.0 109.2 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.498 ' HB3' ' HA3' ' A' ' 1' ' ' GLY . 2.4 ttt -56.53 -19.25 14.74 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.212 -0.93 . . . . 0.0 109.124 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.46 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.3 t -82.88 -33.86 26.85 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.369 -0.832 . . . . 0.0 109.248 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.822 HG22 ' O ' ' A' ' 4' ' ' LYS . 14.6 t -77.13 -17.38 58.67 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.289 -0.882 . . . . 0.0 108.631 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.07 -38.89 24.23 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.501 ' O ' HD13 ' A' ' 13' ' ' LEU . 33.9 pt -69.15 -30.9 47.95 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 9' ' ' ILE . 75.4 m -67.48 -54.07 23.37 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.387 -0.821 . . . . 0.0 109.132 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 57.6 t -52.58 -35.34 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.177 -0.952 . . . . 0.0 108.971 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.489 ' O ' ' HG2' ' A' ' 15' ' ' GLN . 6.5 mt -58.61 -56.3 23.93 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.199 -0.938 . . . . 0.0 109.184 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.535 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 4.2 mp -54.75 -29.58 54.16 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.178 -0.951 . . . . 0.0 109.222 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -57.08 -69.48 0.16 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -0.831 . . . . 0.0 109.531 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 12' ' ' LEU . 4.3 pt20 -52.17 -24.55 7.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.156 -0.965 . . . . 0.0 109.314 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -66.65 -44.86 80.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.46 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.3 t -63.62 -40.94 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.228 -0.92 . . . . 0.0 109.365 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 22' ' ' THR . 62.9 t80 -54.46 -62.52 1.6 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.237 -0.915 . . . . 0.0 109.36 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.589 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.0 pp -64.23 -18.12 64.23 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.172 -0.955 . . . . 0.0 109.332 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.4 tp -71.59 -35.3 70.47 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.285 -0.885 . . . . 0.0 109.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.437 HD11 ' CZ ' ' A' ' 25' ' ' ARG . 38.7 tp -77.13 -42.17 38.97 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.485 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 18' ' ' PHE . 2.2 p -66.73 -25.5 66.54 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -0.882 . . . . 0.0 109.577 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 0.6 OUTLIER -85.09 -33.8 22.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.343 -0.848 . . . . 0.0 109.814 -179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.03 -15.68 57.9 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.161 -0.962 . . . . 0.0 109.716 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' CZ ' HD11 ' A' ' 21' ' ' LEU . 3.0 tpp180 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.543 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.451 ' HA2' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 1 N--CA 1.528 4.815 0 N-CA-C 119.309 2.484 . . . . 0.0 119.309 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m -57.56 -45.23 85.39 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.334 -1.098 . . . . 0.0 109.561 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -56.89 -37.05 70.86 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.286 -0.883 . . . . 0.0 109.572 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' HG2' ' HA2' ' A' ' 1' ' ' GLY . 0.3 OUTLIER -65.44 -56.28 13.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.255 -0.903 . . . . 0.0 109.297 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -18.85 24.3 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.245 -0.909 . . . . 0.0 109.184 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 10' ' ' SER . 23.6 t -85.09 -31.33 23.42 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.28 -0.888 . . . . 0.0 109.406 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.782 ' O ' HG23 ' A' ' 11' ' ' VAL . 48.1 m -81.44 -15.46 55.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 109.154 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.08 -45.9 11.66 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.551 ' HA ' HD12 ' A' ' 12' ' ' LEU . 1.2 pt -68.85 -27.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.519 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.517 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.6 OUTLIER -75.45 -37.99 59.98 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 179.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 7' ' ' THR . 39.8 t -59.85 -39.54 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.299 -0.876 . . . . 0.0 108.964 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 9' ' ' ILE . 63.4 mt -53.28 -43.03 67.14 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.315 -0.866 . . . . 0.0 109.517 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.657 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.1 mm? -71.28 -39.19 71.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.254 -0.903 . . . . 0.0 109.442 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.23 -51.8 41.36 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.234 -0.916 . . . . 0.0 109.527 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -39.44 85.11 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.313 -0.867 . . . . 0.0 109.582 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.01 -41.1 59.56 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.204 -0.935 . . . . 0.0 109.6 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 82.2 t -81.64 -26.42 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.246 -0.909 . . . . 0.0 109.431 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.469 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.25 -65.22 0.71 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.276 -0.89 . . . . 0.0 109.458 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.472 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 3.6 pp -53.57 -19.5 3.92 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.32 -0.862 . . . . 0.0 109.649 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.6 -53.27 12.36 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.128 -0.982 . . . . 0.0 109.73 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.59 ' C ' HD12 ' A' ' 21' ' ' LEU . 2.8 pp -65.7 -30.99 71.75 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -0.91 . . . . 0.0 109.648 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 32.5 p -71.43 -35.58 71.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 109.495 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -66.9 -53.98 26.73 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.256 -0.902 . . . . 0.0 109.523 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.437 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -66.39 -18.91 65.63 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.276 -0.89 . . . . 0.0 109.434 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.056 -0.973 . . . . 0.0 109.466 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.529 4.837 0 N-CA-C 119.406 2.523 . . . . 0.0 119.406 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 t -75.82 -83.67 0.06 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -1.15 . . . . 0.0 109.592 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -47.67 -29.35 2.94 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.178 -0.951 . . . . 0.0 109.43 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -63.73 -58.6 6.36 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 109.309 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.489 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -55.52 -24.5 32.19 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.26 -0.9 . . . . 0.0 109.335 179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.491 ' HA ' HG12 ' A' ' 9' ' ' ILE . 1.4 t -71.19 -36.76 72.06 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.157 -0.964 . . . . 0.0 109.39 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -16.94 57.02 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.223 -0.923 . . . . 0.0 108.826 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.499 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -84.04 -35.3 23.93 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.526 HG13 ' N ' ' A' ' 10' ' ' SER . 12.0 pt -75.88 -29.61 20.22 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.412 -0.805 . . . . 0.0 108.954 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.526 ' N ' HG13 ' A' ' 9' ' ' ILE . 52.9 p -73.24 -47.45 43.08 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.233 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.9 t -63.19 -31.86 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.247 -0.908 . . . . 0.0 109.194 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 8' ' ' ALA . 6.8 mt -66.43 -49.74 65.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.29 -0.881 . . . . 0.0 109.375 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.518 ' CD1' ' N ' ' A' ' 13' ' ' LEU . 1.3 mp -62.81 -25.58 68.32 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.213 -0.93 . . . . 0.0 109.173 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -59.47 -74.0 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.442 -0.786 . . . . 0.0 109.561 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.69 -11.76 55.5 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.293 -0.879 . . . . 0.0 109.582 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.491 ' HB2' ' O ' ' A' ' 12' ' ' LEU . . . -67.31 -69.1 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.236 -0.915 . . . . 0.0 109.189 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 72.7 t -63.22 -28.76 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.301 -0.874 . . . . 0.0 109.091 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.423 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -58.7 -68.5 0.26 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.41 -0.807 . . . . 0.0 109.287 179.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.724 ' C ' HD12 ' A' ' 19' ' ' LEU . 3.7 pp -53.9 -20.48 6.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.286 -0.883 . . . . 0.0 109.275 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.81 -47.51 77.79 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.202 -0.936 . . . . 0.0 109.051 179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.558 ' N ' HD23 ' A' ' 21' ' ' LEU . 1.9 mt -64.76 -41.59 95.78 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.0 m -62.8 -27.39 69.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.409 -0.807 . . . . 0.0 109.048 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.4 -44.83 67.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.374 -0.829 . . . . 0.0 109.234 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' OE1' ' N ' ' A' ' 24' ' ' GLN . 0.0 OUTLIER -70.41 -16.67 62.97 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.302 -0.874 . . . . 0.0 109.064 179.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.6 ttm-85 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 117.963 -1.017 . . . . 0.0 109.42 -179.814 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.804 0 N-CA-C 119.392 2.517 . . . . 0.0 119.392 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 p -78.06 -50.05 12.82 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.242 -1.152 . . . . 0.0 109.612 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -60.97 -38.0 84.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.159 -0.963 . . . . 0.0 109.378 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -69.76 -48.18 60.25 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.226 -0.921 . . . . 0.0 109.213 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.747 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -65.98 -17.61 64.79 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.31 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.483 ' HA ' HG12 ' A' ' 9' ' ' ILE . 0.1 OUTLIER -80.07 -35.91 36.33 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.304 -0.873 . . . . 0.0 109.177 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 90.8 m -80.61 -21.28 41.69 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.318 -0.863 . . . . 0.0 108.917 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -85.04 -37.94 19.77 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.356 -0.84 . . . . 0.0 108.816 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 5' ' ' MET . 1.3 pp -71.12 -31.42 44.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 C-N-CA 119.712 -0.795 . . . . 0.0 108.916 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.76 -55.85 6.87 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.196 -0.94 . . . . 0.0 108.774 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.0 t -53.36 -26.27 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.235 -0.916 . . . . 0.0 108.671 179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.498 HD23 ' HA ' ' A' ' 12' ' ' LEU . 12.2 mt -64.53 -59.73 3.97 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.391 -0.818 . . . . 0.0 108.953 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.525 HD22 ' N ' ' A' ' 13' ' ' LEU . 4.0 mm? -48.88 -29.7 4.99 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.178 -0.951 . . . . 0.0 108.708 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -62.59 -56.62 16.17 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.482 -0.761 . . . . 0.0 109.307 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -52.06 -33.52 39.47 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.244 -0.91 . . . . 0.0 109.491 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.7 -42.2 91.45 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.228 -0.92 . . . . 0.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.462 ' O ' ' HB3' ' A' ' 20' ' ' LEU . 56.0 t -59.23 -41.27 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.247 -0.908 . . . . 0.0 109.5 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.418 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 53.0 t80 -61.27 -56.79 16.53 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.126 -0.984 . . . . 0.0 109.225 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -15.7 42.33 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.24 -0.913 . . . . 0.0 109.318 179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.462 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 14.1 tp -70.37 -50.91 34.03 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.234 -0.916 . . . . 0.0 109.161 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 22' ' ' THR . 1.7 pp -67.49 -27.63 67.17 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.214 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.486 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 63.5 m -82.41 -20.52 36.91 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.267 -0.895 . . . . 0.0 109.507 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.9 m -82.21 -55.33 4.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 109.516 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HG3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -78.04 -26.95 48.65 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.14 -0.975 . . . . 0.0 109.145 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.491 ' N ' ' HG3' ' A' ' 24' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 117.922 -1.037 . . . . 0.0 109.942 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.79 ' HA2' ' CG ' ' A' ' 5' ' ' MET . . . . . . . . 1 N--CA 1.528 4.803 0 N-CA-C 119.561 2.585 . . . . 0.0 119.561 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.437 ' CB ' ' O ' ' A' ' 1' ' ' GLY . 0.7 OUTLIER 70.9 -176.53 0.2 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.345 -1.091 . . . . 0.0 110.006 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -47.17 -30.1 2.7 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.31 -0.869 . . . . 0.0 109.626 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -59.0 6.15 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.2 -0.938 . . . . 0.0 109.381 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.79 ' CG ' ' HA2' ' A' ' 1' ' ' GLY . 0.0 OUTLIER -53.89 -29.93 43.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.182 -0.949 . . . . 0.0 109.493 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.466 ' O ' HG12 ' A' ' 9' ' ' ILE . 8.4 t -70.62 -36.33 73.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.121 -0.987 . . . . 0.0 109.456 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 11' ' ' VAL . 16.8 m -80.1 -17.48 52.48 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.287 -0.883 . . . . 0.0 109.074 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -85.25 -32.74 22.42 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 12' ' ' LEU . 24.3 pt -72.87 -43.24 60.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.517 -0.739 . . . . 0.0 109.3 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.508 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -70.35 -49.46 49.04 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.256 -0.903 . . . . 0.0 108.883 179.669 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 7' ' ' THR . 77.6 t -61.32 -23.57 30.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 O-C-N 121.256 -0.902 . . . . 0.0 108.932 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' ALA . 3.1 mt -65.46 -50.08 66.69 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.287 -0.883 . . . . 0.0 109.283 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.831 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.64 -28.21 69.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.301 -0.874 . . . . 0.0 108.96 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 18' ' ' PHE . . . -77.6 -25.41 49.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.447 -0.783 . . . . 0.0 109.502 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.519 ' CA ' ' OE1' ' A' ' 15' ' ' GLN . 0.3 OUTLIER -79.52 -27.58 41.35 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.279 -0.888 . . . . 0.0 109.483 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.12 -47.98 77.07 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.259 -0.901 . . . . 0.0 109.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.1 t -83.97 -30.07 7.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 O-C-N 121.204 -0.935 . . . . 0.0 109.729 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER -56.95 -62.01 2.04 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.121 -0.987 . . . . 0.0 109.603 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.433 ' HA ' ' OG1' ' A' ' 22' ' ' THR . 87.4 mt -59.12 -28.36 66.47 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.298 -0.876 . . . . 0.0 109.541 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 20' ' ' LEU . 5.4 tp -55.19 -56.25 22.03 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.195 -0.94 . . . . 0.0 109.258 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 tp -60.04 -54.42 46.19 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.243 -0.911 . . . . 0.0 109.244 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 19' ' ' LEU . 82.1 p -47.31 -28.07 1.84 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.199 -0.938 . . . . 0.0 109.29 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.2 t -71.04 -51.29 26.15 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.369 -0.832 . . . . 0.0 109.365 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -66.73 -9.89 41.33 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.233 -0.917 . . . . 0.0 109.33 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.479 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.461 ' O ' ' HB2' ' A' ' 2' ' ' SER . . . . . . . . 1 N--CA 1.528 4.822 0 N-CA-C 119.341 2.497 . . . . 0.0 119.341 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.461 ' HB2' ' O ' ' A' ' 1' ' ' GLY . 51.0 m 64.05 171.92 0.18 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.315 -1.109 . . . . 0.0 109.497 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -59.37 -22.33 61.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.358 -0.839 . . . . 0.0 109.625 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.23 -58.2 7.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.162 -0.961 . . . . 0.0 109.433 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.606 ' O ' HG23 ' A' ' 9' ' ' ILE . 0.0 OUTLIER -64.81 -21.2 66.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.151 -0.968 . . . . 0.0 109.507 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.472 ' O ' HG12 ' A' ' 9' ' ' ILE . 5.6 t -73.83 -36.75 64.96 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.29 -0.882 . . . . 0.0 109.409 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.602 ' O ' HG23 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -80.7 -18.43 47.9 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.271 -0.893 . . . . 0.0 108.835 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -82.75 -30.92 28.65 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.606 HG23 ' O ' ' A' ' 5' ' ' MET . 33.3 pt -75.16 -39.96 43.65 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.357 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.532 ' N ' HG13 ' A' ' 9' ' ' ILE . 0.3 OUTLIER -67.89 -36.61 80.53 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.312 -0.867 . . . . 0.0 108.683 179.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 7' ' ' THR . 21.4 t -60.02 -45.93 94.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.5 mt -51.03 -55.63 16.54 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.282 -0.886 . . . . 0.0 109.136 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.9 mm? -57.29 -31.9 66.09 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.162 -0.962 . . . . 0.0 108.937 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' VAL . . . -54.68 -57.1 12.79 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.295 -0.878 . . . . 0.0 108.888 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -59.19 -31.75 69.3 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.319 -0.863 . . . . 0.0 108.92 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 13' ' ' LEU . . . -59.54 -36.57 76.39 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.307 -0.871 . . . . 0.0 108.933 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.7 t -78.42 -32.55 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 O-C-N 121.3 -0.875 . . . . 0.0 108.855 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 49.0 t80 -57.97 -59.83 4.66 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.381 -0.824 . . . . 0.0 108.947 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.73 -21.85 4.56 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.28 -0.888 . . . . 0.0 108.834 179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD23 ' O ' ' A' ' 20' ' ' LEU . 3.8 tt -66.51 -54.78 20.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.404 -0.81 . . . . 0.0 109.273 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.45 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.9 pp -64.49 -25.58 68.06 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.269 -0.894 . . . . 0.0 109.096 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 m -63.2 -49.3 74.76 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.319 -0.863 . . . . 0.0 109.348 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -47.84 66.9 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.242 -0.911 . . . . 0.0 109.159 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -71.53 -5.1 30.7 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.296 -0.878 . . . . 0.0 109.389 179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' LEU . 2.3 ttt-85 . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.48 -179.957 . . . . . . . . 1 1 . 1 stop_ save_