data_2n6i_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 2n6i _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.55 ' CD ' HH21 ' A' ' 21' ' ' ARG . 2.1 pp0? . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.469 0.176 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 12' ' ' PHE . 14.7 ptmm? . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CE1' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.482 ' CD1' ' H ' ' A' ' 13' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.14 0 CA-C-O 121.633 0.73 . . . . 0.0 110.76 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.7 mmm-85 . . . . . 0 C--O 1.241 0.63 0 CA-C-O 121.37 0.605 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.503 ' CG2' ' H ' ' A' ' 19' ' ' THR . 8.9 p -61.26 172.72 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.66 0.267 . . . . 0.0 110.417 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.532 ' OG1' ' CE1' ' A' ' 12' ' ' PHE . 9.8 t -137.79 159.87 40.81 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 tp -139.23 129.3 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 121.313 0.578 . . . . 0.0 111.618 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.55 HH21 ' CD ' ' A' ' 10' ' ' GLN . 15.9 ptm180 -135.88 141.87 44.65 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.287 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -62.73 -36.17 82.14 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.43 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HA ' HE22 ' A' ' 10' ' ' GLN . 21.9 ptmt . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.267 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.71 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 12' ' ' PHE . 6.6 mtpm? . . . . . 0 C--O 1.232 0.143 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 11' ' ' LYS . 7.4 p90 . . . . . 0 CA--C 1.504 -0.806 0 CA-C-O 121.418 0.628 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.0 pt . . . . . 0 C--O 1.227 -0.122 0 CA-C-O 123.004 1.383 . . . . 0.0 110.05 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.451 ' N ' ' OG1' ' A' ' 19' ' ' THR . 21.3 tpp180 . . . . . 0 C--O 1.24 0.568 0 CA-C-O 121.704 0.764 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.504 ' N ' ' OG1' ' A' ' 19' ' ' THR . 9.0 p . . . . . 0 CA--C 1.524 -0.048 0 CA-C-O 120.654 0.264 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.696 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.434 ' CG1' ' O ' ' A' ' 18' ' ' VAL . 57.4 t -84.18 34.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.564 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.504 ' OG1' ' N ' ' A' ' 15' ' ' VAL . 94.1 m -120.04 129.09 54.07 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.484 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 8.7 tp -167.3 154.66 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 118.076 -1.449 . . . . 0.0 114.015 -178.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.47 ' H ' HD11 ' A' ' 20' ' ' ILE . 18.8 tpp180 -108.58 89.19 2.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 113.722 -1.581 . . . . 0.0 109.327 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 23' ' ' LYS . 17.9 tp10 -64.76 -39.16 93.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.351 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.596 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 23.4 tptm . . . . . 0 N--CA 1.439 -0.997 0 C-N-CA 124.664 1.186 . . . . 0.0 113.372 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.628 HE22 ' CG ' ' A' ' 21' ' ' ARG . 14.1 mp0 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.608 ' CB ' ' HZ2' ' A' ' 11' ' ' LYS . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.552 0.215 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.416 ' CD1' ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.136 0.493 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 . . . . . 0 C--O 1.237 0.412 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.492 ' CA ' ' HG1' ' A' ' 19' ' ' THR . 64.2 t . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.834 0.826 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.5 t -94.2 87.16 2.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.492 ' HG1' ' CA ' ' A' ' 15' ' ' VAL . 67.1 m -152.85 152.54 31.67 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.751 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mm -134.67 134.25 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.836 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.628 ' CG ' HE22 ' A' ' 10' ' ' GLN . 13.7 tpt180 -172.34 165.8 5.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 8.3 mp0 -75.66 100.32 4.6 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.571 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? . . . . . 0 C--N 1.332 -0.155 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.721 179.593 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.727 ' N ' HH12 ' A' ' 21' ' ' ARG . 70.6 mt-30 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.584 ' HA ' HH12 ' A' ' 21' ' ' ARG . 14.2 mmmm . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.558 ' CE1' ' CG ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 121.248 0.547 . . . . 0.0 111.723 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 N--CA 1.466 0.348 0 CA-C-O 121.37 0.605 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.9 ttm-85 . . . . . 0 C--O 1.24 0.575 0 CA-C-O 121.274 0.559 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.672 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -65.16 -178.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 120.88 0.371 . . . . 0.0 110.906 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.548 ' OG1' ' CZ ' ' A' ' 12' ' ' PHE . 10.1 t -143.25 152.42 41.69 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.677 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 12.6 tt -154.74 142.3 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.458 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.815 ' NE ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -170.29 -170.55 0.97 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.196 -179.556 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.592 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 4.9 mm-40 -58.95 -42.42 89.78 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.131 0.423 . . . . 0.0 112.04 -176.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.815 ' H ' ' NE ' ' A' ' 21' ' ' ARG . 24.4 ttmm . . . . . 0 N--CA 1.439 -1.025 0 C-N-CA 122.74 0.416 . . . . 0.0 110.777 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.78 ' NE2' HH12 ' A' ' 21' ' ' ARG . 94.2 mm-40 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' C ' ' O ' ' A' ' 12' ' ' PHE . 27.8 mtpp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.632 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 5.9 p90 . . . . . 0 N--CA 1.472 0.666 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.479 HG12 ' H ' ' A' ' 11' ' ' LYS . 12.8 tt . . . . . 0 N--CA 1.468 0.457 0 CA-C-O 120.656 0.265 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 121.369 0.604 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 34.3 m -89.79 81.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 68.4 p -135.78 -177.59 4.75 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.373 -178.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.632 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 12.9 tt -141.65 161.36 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.78 HH12 ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -101.74 106.17 17.15 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.744 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 17.9 tp10 -86.09 -50.34 7.1 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.473 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.636 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 41.2 ttmt . . . . . 0 C--N 1.343 0.32 0 O-C-N 123.655 0.597 . . . . 0.0 112.239 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.611 ' C ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.516 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.631 ' CB ' ' HZ2' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 122.534 1.159 . . . . 0.0 112.944 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.446 ' C ' ' CD1' ' A' ' 12' ' ' PHE . 11.6 p90 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.561 ' CD1' ' H ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.711 0.767 . . . . 0.0 110.393 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.52 ' N ' ' OG1' ' A' ' 19' ' ' THR . 30.1 tpt180 . . . . . 0 C--O 1.243 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.407 ' N ' ' HG1' ' A' ' 19' ' ' THR . 33.0 m . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 120.889 0.376 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 18' ' ' VAL . 58.8 t -88.19 28.32 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.247 0.546 . . . . 0.0 111.202 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.52 ' OG1' ' N ' ' A' ' 14' ' ' ARG . 96.9 m -120.26 122.46 40.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.395 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.445 HD11 ' H ' ' A' ' 21' ' ' ARG . 8.2 tp -172.2 161.75 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.385 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.445 ' H ' HD11 ' A' ' 20' ' ' ILE . 44.6 ttm180 -107.95 133.49 52.2 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-O 121.613 0.721 . . . . 0.0 110.954 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 176.35 -18.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.449 -0.515 0 CA-C-N 113.565 -1.652 . . . . 0.0 110.53 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.641 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.567 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.498 ' O ' ' C ' ' A' ' 11' ' ' LYS . 9.9 p90 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.491 ' CG2' ' NH2' ' A' ' 21' ' ' ARG . 80.4 mt . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.685 0.279 . . . . 0.0 111.458 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.547 HH12 ' C ' ' A' ' 17' ' ' GLY . 67.8 mtm-85 . . . . . 0 C--O 1.243 0.732 0 CA-C-O 121.528 0.68 . . . . 0.0 112.6 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 120.708 0.29 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.547 ' C ' HH12 ' A' ' 14' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.497 ' N ' HH12 ' A' ' 14' ' ' ARG . 34.1 m -129.4 159.98 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 120.816 0.341 . . . . 0.0 110.545 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.2 t -138.84 121.72 16.58 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.584 ' N ' ' CD1' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -155.19 169.72 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 111.047 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.554 ' CG ' HE22 ' A' ' 10' ' ' GLN . 20.8 tpp180 -162.34 167.31 24.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.192 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.524 ' H ' ' HD3' ' A' ' 21' ' ' ARG . 15.8 pt-20 -86.04 45.55 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.817 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.877 ' H ' ' HZ1' ' A' ' 23' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.293 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.853 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.764 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.087 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.736 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.835 0.826 . . . . 0.0 112.963 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' O ' ' A' ' 11' ' ' LYS . 4.5 p90 . . . . . 0 N--CA 1.461 0.088 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.537 ' CD1' ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.175 0.512 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.513 ' N ' ' HD2' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.44 0 CA-C-O 120.956 0.407 . . . . 0.0 110.036 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.053 0.454 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.9 t -109.81 112.79 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.522 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 82.5 p -116.02 87.42 2.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.982 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.522 ' HB ' ' O ' ' A' ' 19' ' ' THR . 0.0 OUTLIER 163.75 126.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 124.142 0.901 . . . . 0.0 110.67 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.736 ' HE ' ' N ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -160.16 173.96 14.99 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.447 176.4 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 21' ' ' ARG . 68.4 mm-40 21.95 44.23 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.214 0.605 . . . . 0.0 112.48 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.18 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.479 ' CB ' ' H ' ' A' ' 22' ' ' GLU . 2.6 tp-100 . . . . . 0 N--CA 1.438 -1.046 0 CA-C-O 120.55 0.214 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.546 ' CB ' ' HZ2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.81 0.338 . . . . 0.0 111.491 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.584 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 16.0 p90 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.0 mt . . . . . 0 N--CA 1.467 0.406 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 121.052 0.454 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 67.4 t . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -86.86 171.41 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.722 ' HG1' ' H ' ' A' ' 20' ' ' ILE . 10.0 t -163.46 176.7 9.52 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.314 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.722 ' H ' ' HG1' ' A' ' 19' ' ' THR . 48.5 mm -133.68 152.73 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.639 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -108.11 -178.56 3.64 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.812 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.528 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 3.5 tm-20 71.36 -35.14 0.32 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.639 ' H ' ' C ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--N 1.341 0.235 0 C-N-CA 125.169 1.388 . . . . 0.0 111.793 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.777 HE21 ' HE ' ' A' ' 21' ' ' ARG . 1.9 pp0? . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.561 0.219 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.432 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 64.0 pttt . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.564 ' CE2' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.2 tp . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 121.798 0.809 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.504 ' H ' ' CG2' ' A' ' 15' ' ' VAL . 27.3 mmm180 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 121.381 0.61 . . . . 0.0 111.841 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.504 ' CG2' ' H ' ' A' ' 14' ' ' ARG . 7.6 p . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.352 0.12 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -99.6 92.62 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.564 ' OG1' ' CE2' ' A' ' 12' ' ' PHE . 82.6 p -134.78 165.94 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.668 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.577 ' CD1' ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.84 152.28 12.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.298 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.777 ' HE ' HE21 ' A' ' 10' ' ' GLN . 0.3 OUTLIER -177.32 -171.19 0.32 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.299 0.571 . . . . 0.0 112.454 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 23' ' ' LYS . 4.7 mm-40 -95.81 -7.21 37.66 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.752 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.456 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 21.7 ptmt . . . . . 0 N--CA 1.462 0.17 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.957 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.55 ' CD ' HH21 ' A' ' 21' ' ' ARG . 2.1 pp0? . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.469 0.176 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 12' ' ' PHE . 14.7 ptmm? . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CE1' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.482 ' CD1' ' H ' ' A' ' 13' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.14 0 CA-C-O 121.633 0.73 . . . . 0.0 110.76 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.7 mmm-85 . . . . . 0 C--O 1.241 0.63 0 CA-C-O 121.37 0.605 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.603 ' C15' ' H ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.603 ' H ' ' C15' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.503 ' CG2' ' H ' ' A' ' 19' ' ' THR . 8.9 p -61.26 172.72 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.66 0.267 . . . . 0.0 110.417 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.532 ' OG1' ' CE1' ' A' ' 12' ' ' PHE . 9.8 t -137.79 159.87 40.81 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 tp -139.23 129.3 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 121.313 0.578 . . . . 0.0 111.618 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.55 HH21 ' CD ' ' A' ' 10' ' ' GLN . 15.9 ptm180 -135.88 141.87 44.65 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.287 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -62.73 -36.17 82.14 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.43 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HA ' HE22 ' A' ' 10' ' ' GLN . 21.9 ptmt 34.76 -151.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.267 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.427 0 O-C-N 120.052 -1.655 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . 0.459 ' N ' ' O ' ' A' ' 11' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.71 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.633 ' N ' ' CD1' ' A' ' 12' ' ' PHE . 6.6 mtpm? . . . . . 0 C--O 1.232 0.143 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 11' ' ' LYS . 7.4 p90 . . . . . 0 CA--C 1.504 -0.806 0 CA-C-O 121.418 0.628 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.0 pt . . . . . 0 C--O 1.227 -0.122 0 CA-C-O 123.004 1.383 . . . . 0.0 110.05 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.451 ' N ' ' OG1' ' A' ' 19' ' ' THR . 21.3 tpp180 . . . . . 0 C--O 1.24 0.568 0 CA-C-O 121.704 0.764 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.504 ' N ' ' OG1' ' A' ' 19' ' ' THR . 9.0 p . . . . . 0 CA--C 1.524 -0.048 0 CA-C-O 120.654 0.264 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.559 ' C15' ' H ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.559 ' H ' ' C15' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.525 0.696 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.434 ' CG1' ' O ' ' A' ' 18' ' ' VAL . 57.4 t -84.18 34.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.564 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.504 ' OG1' ' N ' ' A' ' 15' ' ' VAL . 94.1 m -120.04 129.09 54.07 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.484 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 8.7 tp -167.3 154.66 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 118.076 -1.449 . . . . 0.0 114.015 -178.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.47 ' H ' HD11 ' A' ' 20' ' ' ILE . 18.8 tpp180 -108.58 89.19 2.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 113.722 -1.581 . . . . 0.0 109.327 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 23' ' ' LYS . 17.9 tp10 -64.76 -39.16 93.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.351 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.596 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 23.4 tptm -8.7 123.58 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 124.664 1.186 . . . . 0.0 113.372 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.374 0 O-C-N 119.98 -1.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.628 HE22 ' CG ' ' A' ' 21' ' ' ARG . 14.1 mp0 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.608 ' HZ2' ' CB ' ' A' ' 11' ' ' LYS . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.552 0.215 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.416 ' CD1' ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.136 0.493 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 . . . . . 0 C--O 1.237 0.412 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.492 ' CA ' ' HG1' ' A' ' 19' ' ' THR . 64.2 t . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.834 0.826 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.717 ' HAK' ' H ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.717 ' H ' ' HAK' ' A' ' 16' ' ' 4FU . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.5 t -94.2 87.16 2.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.492 ' HG1' ' CA ' ' A' ' 15' ' ' VAL . 67.1 m -152.85 152.54 31.67 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.751 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mm -134.67 134.25 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.836 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.628 ' CG ' HE22 ' A' ' 10' ' ' GLN . 13.7 tpt180 -172.34 165.8 5.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 8.3 mp0 -75.66 100.32 4.6 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.571 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -92.96 144.33 25.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.721 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.312 0 O-C-N 120.055 -1.653 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.727 ' N ' HH12 ' A' ' 21' ' ' ARG . 70.6 mt-30 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.584 ' HA ' HH12 ' A' ' 21' ' ' ARG . 14.2 mmmm . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.558 ' CE1' ' CG ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 121.248 0.547 . . . . 0.0 111.723 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 N--CA 1.466 0.348 0 CA-C-O 121.37 0.605 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.9 ttm-85 . . . . . 0 C--O 1.24 0.575 0 CA-C-O 121.274 0.559 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.607 ' C15' ' H ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.607 ' H ' ' C15' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.525 0.672 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -65.16 -178.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 120.88 0.371 . . . . 0.0 110.906 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.548 ' OG1' ' CZ ' ' A' ' 12' ' ' PHE . 10.1 t -143.25 152.42 41.69 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.677 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 12.6 tt -154.74 142.3 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.458 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.815 ' NE ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -170.29 -170.55 0.97 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.196 -179.556 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.592 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 4.9 mm-40 -58.95 -42.42 89.78 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.131 0.423 . . . . 0.0 112.04 -176.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.815 ' H ' ' NE ' ' A' ' 21' ' ' ARG . 24.4 ttmm 57.04 122.09 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 122.74 0.416 . . . . 0.0 110.777 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . 0.683 ' N ' HE22 ' A' ' 10' ' ' GLN . . . . . . . . 0 C--N 1.305 -1.326 0 O-C-N 119.834 -1.791 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.78 ' NE2' HH12 ' A' ' 21' ' ' ARG . 94.2 mm-40 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' C ' ' O ' ' A' ' 12' ' ' PHE . 27.8 mtpp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.632 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 5.9 p90 . . . . . 0 N--CA 1.472 0.666 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.479 HG12 ' H ' ' A' ' 11' ' ' LYS . 12.8 tt . . . . . 0 N--CA 1.468 0.457 0 CA-C-O 120.656 0.265 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 121.369 0.604 . . . . 0.0 111.899 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.714 ' HAK' ' H ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.714 ' H ' ' HAK' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 34.3 m -89.79 81.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 68.4 p -135.78 -177.59 4.75 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.373 -178.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.632 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 12.9 tt -141.65 161.36 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.78 HH12 ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -101.74 106.17 17.15 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.744 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 17.9 tp10 -86.09 -50.34 7.1 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.473 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.636 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 41.2 ttmt 22.45 86.9 0.01 OUTLIER 'General case' 0 C--N 1.343 0.32 0 O-C-N 123.655 0.597 . . . . 0.0 112.239 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.295 0 O-C-N 119.976 -1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . 0.628 ' N ' ' N ' ' A' ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.618 ' NE2' ' N ' ' A' ' 9' ' ' NH2 . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.516 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.631 ' HZ2' ' CB ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 122.534 1.159 . . . . 0.0 112.944 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.446 ' CD1' ' C ' ' A' ' 12' ' ' PHE . 11.6 p90 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.561 ' CD1' ' H ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.711 0.767 . . . . 0.0 110.393 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.52 ' N ' ' OG1' ' A' ' 19' ' ' THR . 30.1 tpt180 . . . . . 0 C--O 1.243 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.553 ' N ' ' HAG' ' A' ' 16' ' ' 4FU . 33.0 m . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 120.889 0.376 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.574 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.574 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 18' ' ' VAL . 58.8 t -88.19 28.32 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.247 0.546 . . . . 0.0 111.202 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.534 ' HG1' ' C15' ' A' ' 16' ' ' 4FU . 96.9 m -120.26 122.46 40.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.395 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.445 HD11 ' H ' ' A' ' 21' ' ' ARG . 8.2 tp -172.2 161.75 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.385 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.445 ' H ' HD11 ' A' ' 20' ' ' ILE . 44.6 ttm180 -107.95 133.49 52.2 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-O 121.613 0.721 . . . . 0.0 110.954 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 176.35 -18.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -78.59 43.46 0.48 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.565 -1.652 . . . . 0.0 110.53 179.195 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . 0.628 ' N ' ' N ' ' A' ' 9' ' ' NH2 . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 120.055 -1.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.641 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.567 ' HB3' ' NZ ' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.498 ' O ' ' C ' ' A' ' 11' ' ' LYS . 9.9 p90 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.491 ' CG2' ' NH2' ' A' ' 21' ' ' ARG . 80.4 mt . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.685 0.279 . . . . 0.0 111.458 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.547 HH12 ' C ' ' A' ' 17' ' ' GLY . 67.8 mtm-85 . . . . . 0 C--O 1.243 0.732 0 CA-C-O 121.528 0.68 . . . . 0.0 112.6 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 120.708 0.29 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.547 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.547 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.497 ' N ' HH12 ' A' ' 14' ' ' ARG . 34.1 m -129.4 159.98 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 120.816 0.341 . . . . 0.0 110.545 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.2 t -138.84 121.72 16.58 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.584 ' CD1' ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -155.19 169.72 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 111.047 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.554 ' CG ' HE22 ' A' ' 10' ' ' GLN . 20.8 tpp180 -162.34 167.31 24.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.192 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.524 ' H ' ' HD3' ' A' ' 21' ' ' ARG . 15.8 pt-20 -86.04 45.55 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.817 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.877 ' H ' ' HZ1' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -38.27 -29.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.853 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . 0.417 ' N ' ' O ' ' A' ' 22' ' ' GLU . . . . . . . . 0 C--N 1.304 -1.381 0 O-C-N 120.033 -1.667 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.764 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.087 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.736 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.835 0.826 . . . . 0.0 112.963 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' O ' ' A' ' 11' ' ' LYS . 4.5 p90 . . . . . 0 N--CA 1.461 0.088 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.537 ' CD1' ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.175 0.512 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.513 ' N ' ' HD2' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.44 0 CA-C-O 120.956 0.407 . . . . 0.0 110.036 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.053 0.454 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.553 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.553 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.9 t -109.81 112.79 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.522 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 82.5 p -116.02 87.42 2.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.982 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.522 ' HB ' ' O ' ' A' ' 19' ' ' THR . 0.0 OUTLIER 163.75 126.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 124.142 0.901 . . . . 0.0 110.67 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.736 ' HE ' ' N ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -160.16 173.96 14.99 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.447 176.4 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 21' ' ' ARG . 68.4 mm-40 21.95 44.23 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.214 0.605 . . . . 0.0 112.48 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -80.0 -3.17 47.26 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.268 0 O-C-N 119.993 -1.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.479 ' CB ' ' H ' ' A' ' 22' ' ' GLU . 2.6 tp-100 . . . . . 0 N--CA 1.438 -1.046 0 CA-C-O 120.55 0.214 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.546 ' HZ2' ' CB ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.81 0.338 . . . . 0.0 111.491 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.584 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 16.0 p90 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.0 mt . . . . . 0 N--CA 1.467 0.406 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 121.052 0.454 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 67.4 t . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.566 ' O1 ' ' HAK' ' A' ' 16' ' ' 4FU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -86.86 171.41 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.722 ' HG1' ' H ' ' A' ' 20' ' ' ILE . 10.0 t -163.46 176.7 9.52 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.314 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.722 ' H ' ' HG1' ' A' ' 19' ' ' THR . 48.5 mm -133.68 152.73 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.639 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -108.11 -178.56 3.64 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.812 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.528 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 3.5 tm-20 71.36 -35.14 0.32 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.639 ' H ' ' C ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 5.58 115.23 0.0 OUTLIER 'General case' 0 C--N 1.341 0.235 0 C-N-CA 125.169 1.388 . . . . 0.0 111.793 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.333 0 O-C-N 119.973 -1.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.777 HE21 ' HE ' ' A' ' 21' ' ' ARG . 1.9 pp0? . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.561 0.219 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.432 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 64.0 pttt . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.564 ' CE2' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.2 tp . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 121.798 0.809 . . . . 0.0 111.988 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.504 ' H ' ' CG2' ' A' ' 15' ' ' VAL . 27.3 mmm180 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 121.381 0.61 . . . . 0.0 111.841 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.504 ' CG2' ' H ' ' A' ' 14' ' ' ARG . 7.6 p . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.352 0.12 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' 4FU . . . . . 0.617 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.617 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -99.6 92.62 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.564 ' OG1' ' CE2' ' A' ' 12' ' ' PHE . 82.6 p -134.78 165.94 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.668 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.577 ' CD1' ' N ' ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.84 152.28 12.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.298 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.777 ' HE ' HE21 ' A' ' 10' ' ' GLN . 0.3 OUTLIER -177.32 -171.19 0.32 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.299 0.571 . . . . 0.0 112.454 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' A' ' 24' ' ' NH2 . 4.7 mm-40 -95.81 -7.21 37.66 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.752 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.456 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 21.7 ptmt 29.7 34.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.957 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' NH2 . . . . . 0.501 ' N ' ' O ' ' A' ' 22' ' ' GLU . . . . . . . . 0 C--N 1.306 -1.306 0 O-C-N 119.968 -1.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.871 ' NE2' HH21 ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.469 0.176 . . . . 0.0 111.12 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 12' ' ' PHE . 14.7 ptmm? . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CE1' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.671 ' N ' HD13 ' A' ' 13' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.14 0 CA-C-O 121.633 0.73 . . . . 0.0 110.76 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.434 ' N ' ' O ' ' A' ' 18' ' ' VAL . 44.7 mmm-85 . . . . . 0 C--O 1.241 0.63 0 CA-C-O 121.37 0.605 . . . . 0.0 110.887 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 15' ' ' VAL . 33.4 m . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.656 HG22 ' N ' ' A' ' 19' ' ' THR . 8.9 p -61.26 172.72 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.66 0.267 . . . . 0.0 110.417 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.656 ' N ' HG22 ' A' ' 18' ' ' VAL . 9.8 t -137.79 159.87 40.81 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 tp -139.23 129.3 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 121.313 0.578 . . . . 0.0 111.618 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.871 HH21 ' NE2' ' A' ' 10' ' ' GLN . 15.9 ptm180 -135.88 141.87 44.65 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.287 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -62.73 -36.17 82.14 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.43 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB3' ' NE ' ' A' ' 21' ' ' ARG . 21.9 ptmt . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.267 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.71 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.635 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 C--O 1.232 0.143 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 11' ' ' LYS . 7.4 p90 . . . . . 0 CA--C 1.504 -0.806 0 CA-C-O 121.418 0.628 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.417 HG21 HD13 ' A' ' 13' ' ' ILE . 26.0 pt . . . . . 0 C--O 1.227 -0.122 0 CA-C-O 123.004 1.383 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.451 ' N ' ' OG1' ' A' ' 19' ' ' THR . 21.3 tpp180 . . . . . 0 C--O 1.24 0.568 0 CA-C-O 121.704 0.764 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.812 ' N ' ' HG1' ' A' ' 19' ' ' THR . 9.0 p . . . . . 0 CA--C 1.524 -0.048 0 CA-C-O 120.654 0.264 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.696 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 18' ' ' VAL . 57.4 t -84.18 34.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.564 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.812 ' HG1' ' N ' ' A' ' 15' ' ' VAL . 94.1 m -120.04 129.09 54.07 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.484 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 8.7 tp -167.3 154.66 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 118.076 -1.449 . . . . 0.0 114.015 -178.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.45 HH12 ' HA ' ' A' ' 10' ' ' GLN . 18.8 tpp180 -108.58 89.19 2.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 113.722 -1.581 . . . . 0.0 109.327 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 23' ' ' LYS . 17.9 tp10 -64.76 -39.16 93.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.351 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.596 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 23.4 tptm . . . . . 0 N--CA 1.439 -0.997 0 C-N-CA 124.664 1.186 . . . . 0.0 113.372 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.662 HE22 ' CG ' ' A' ' 21' ' ' ARG . 14.1 mp0 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.638 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.552 0.215 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.615 HG23 ' HG3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.136 0.493 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.615 ' HG3' HG23 ' A' ' 13' ' ' ILE . 22.6 tpp180 . . . . . 0 C--O 1.237 0.412 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.556 ' N ' ' HG1' ' A' ' 19' ' ' THR . 64.2 t . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.834 0.826 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.5 t -94.2 87.16 2.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.556 ' HG1' ' N ' ' A' ' 15' ' ' VAL . 67.1 m -152.85 152.54 31.67 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.751 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mm -134.67 134.25 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.836 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.662 ' CG ' HE22 ' A' ' 10' ' ' GLN . 13.7 tpt180 -172.34 165.8 5.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 8.3 mp0 -75.66 100.32 4.6 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.571 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? . . . . . 0 C--N 1.332 -0.155 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.721 179.593 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.727 ' N ' HH12 ' A' ' 21' ' ' ARG . 37.6 mt-30 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' HH12 ' A' ' 21' ' ' ARG . 14.2 mmmm . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.568 ' HD1' ' N ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 121.248 0.547 . . . . 0.0 111.723 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 N--CA 1.466 0.348 0 CA-C-O 121.37 0.605 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.9 ttm-85 . . . . . 0 C--O 1.24 0.575 0 CA-C-O 121.274 0.559 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.4 p . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.672 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -65.16 -178.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 120.88 0.371 . . . . 0.0 110.906 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.546 ' OG1' ' CZ ' ' A' ' 12' ' ' PHE . 10.1 t -143.25 152.42 41.69 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.677 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.429 HG22 ' CG2' ' A' ' 15' ' ' VAL . 12.6 tt -154.74 142.3 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.458 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.873 ' NE ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -170.29 -170.55 0.97 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.196 -179.556 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.592 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 4.9 mm-40 -58.95 -42.42 89.78 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.131 0.423 . . . . 0.0 112.04 -176.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.873 ' H ' ' NE ' ' A' ' 21' ' ' ARG . 24.4 ttmm . . . . . 0 N--CA 1.439 -1.025 0 C-N-CA 122.74 0.416 . . . . 0.0 110.777 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.492 ' CD ' HH12 ' A' ' 21' ' ' ARG . 28.8 mm100 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' C ' ' O ' ' A' ' 12' ' ' PHE . 27.8 mtpp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.632 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 5.9 p90 . . . . . 0 N--CA 1.472 0.666 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.8 tt . . . . . 0 N--CA 1.468 0.457 0 CA-C-O 120.656 0.265 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.692 ' HG2' HG12 ' A' ' 15' ' ' VAL . 44.5 mmm-85 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 121.369 0.604 . . . . 0.0 111.899 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.692 HG12 ' HG2' ' A' ' 14' ' ' ARG . 48.3 t . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 18' ' ' VAL . 34.3 m -89.79 81.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 68.4 p -135.78 -177.59 4.75 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.373 -178.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.632 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 12.9 tt -141.65 161.36 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.737 ' HE ' ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -101.74 106.17 17.15 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.737 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 17.9 tp10 -86.09 -50.34 7.1 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.473 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.671 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 41.2 ttmt . . . . . 0 C--N 1.343 0.32 0 O-C-N 123.655 0.597 . . . . 0.0 112.239 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.461 ' OE1' ' C ' ' A' ' 10' ' ' GLN . 10.3 tm0? . . . . . 0 N--CA 1.429 -1.516 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.686 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 122.534 1.159 . . . . 0.0 112.944 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.446 ' CD1' ' C ' ' A' ' 12' ' ' PHE . 11.6 p90 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.647 ' N ' HD13 ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.711 0.767 . . . . 0.0 110.393 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.985 ' N ' ' HG1' ' A' ' 19' ' ' THR . 30.1 tpt180 . . . . . 0 C--O 1.243 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 15' ' ' VAL . 33.0 m . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 120.889 0.376 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.701 ' O ' HG12 ' A' ' 18' ' ' VAL . 58.8 t -88.19 28.32 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.247 0.546 . . . . 0.0 111.202 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.985 ' HG1' ' N ' ' A' ' 14' ' ' ARG . 96.9 m -120.26 122.46 40.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.395 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.42 HG13 ' N ' ' A' ' 21' ' ' ARG . 8.2 tp -172.2 161.75 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.385 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' N ' HG13 ' A' ' 20' ' ' ILE . 44.6 ttm180 -107.95 133.49 52.2 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-O 121.613 0.721 . . . . 0.0 110.954 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 176.35 -18.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.542 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.449 -0.515 0 CA-C-N 113.565 -1.652 . . . . 0.0 110.53 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.788 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.612 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.498 ' O ' ' C ' ' A' ' 11' ' ' LYS . 9.9 p90 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.947 HG23 ' NH2' ' A' ' 21' ' ' ARG . 80.4 mt . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.685 0.279 . . . . 0.0 111.458 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.568 HH12 ' C ' ' A' ' 17' ' ' GLY . 67.8 mtm-85 . . . . . 0 C--O 1.243 0.732 0 CA-C-O 121.528 0.68 . . . . 0.0 112.6 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.5 p . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 120.708 0.29 . . . . 0.0 110.433 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.568 ' C ' HH12 ' A' ' 14' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.513 ' N ' HH12 ' A' ' 14' ' ' ARG . 34.1 m -129.4 159.98 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 120.816 0.341 . . . . 0.0 110.545 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.495 HG23 ' O ' ' A' ' 19' ' ' THR . 10.2 t -138.84 121.72 16.58 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.783 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -155.19 169.72 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 111.047 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 13' ' ' ILE . 20.8 tpp180 -162.34 167.31 24.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.192 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.53 ' H ' ' HD3' ' A' ' 21' ' ' ARG . 15.8 pt-20 -86.04 45.55 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.817 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.895 ' HZ3' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.293 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.853 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.603 ' OE1' ' N ' ' A' ' 10' ' ' GLN . 15.3 mp0 . . . . . 0 N--CA 1.461 0.087 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.794 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.835 0.826 . . . . 0.0 112.963 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' O ' ' A' ' 11' ' ' LYS . 4.5 p90 . . . . . 0 N--CA 1.461 0.088 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.719 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.175 0.512 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.44 0 CA-C-O 120.956 0.407 . . . . 0.0 110.036 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.647 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.1 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.053 0.454 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.9 t -109.81 112.79 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.531 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 82.5 p -116.02 87.42 2.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.982 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.7 ' C ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 163.75 126.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 124.142 0.901 . . . . 0.0 110.67 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.794 ' HE ' ' N ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -160.16 173.96 14.99 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.447 176.4 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 21' ' ' ARG . 68.4 mm-40 21.95 44.23 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.214 0.605 . . . . 0.0 112.48 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.18 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.533 ' CB ' ' H ' ' A' ' 22' ' ' GLU . 34.9 tp60 . . . . . 0 N--CA 1.438 -1.046 0 CA-C-O 120.55 0.214 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.571 ' NZ ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.81 0.338 . . . . 0.0 111.491 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.584 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 16.0 p90 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.0 mt . . . . . 0 N--CA 1.467 0.406 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 121.052 0.454 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 67.4 t . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -86.86 171.41 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 t -163.46 176.7 9.52 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.314 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.584 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 48.5 mm -133.68 152.73 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.627 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -108.11 -178.56 3.64 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.812 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.533 ' H ' ' CB ' ' A' ' 10' ' ' GLN . 3.5 tm-20 71.36 -35.14 0.32 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.627 ' H ' ' C ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--N 1.341 0.235 0 C-N-CA 125.169 1.388 . . . . 0.0 111.793 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.491 ' HG3' ' NE ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.561 0.219 . . . . 0.0 110.963 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 64.0 pttt . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.542 ' N ' ' CD1' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.579 ' O ' HG23 ' A' ' 13' ' ' ILE . 7.2 tp . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 121.798 0.809 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.667 ' N ' HG22 ' A' ' 15' ' ' VAL . 27.3 mmm180 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 121.381 0.61 . . . . 0.0 111.841 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.667 HG22 ' N ' ' A' ' 14' ' ' ARG . 7.6 p . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.352 0.12 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -99.6 92.62 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.499 ' OG1' ' CE2' ' A' ' 12' ' ' PHE . 82.6 p -134.78 165.94 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.668 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.765 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.84 152.28 12.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.298 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.634 ' NH1' ' HB2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -177.32 -171.19 0.32 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.299 0.571 . . . . 0.0 112.454 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 23' ' ' LYS . 4.7 mm-40 -95.81 -7.21 37.66 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.752 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.506 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 21.7 ptmt . . . . . 0 N--CA 1.462 0.17 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.957 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.871 ' NE2' HH21 ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.469 0.176 . . . . 0.0 111.12 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 12' ' ' PHE . 14.7 ptmm? . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CE1' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.671 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.14 0 CA-C-O 121.633 0.73 . . . . 0.0 110.76 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.434 ' N ' ' O ' ' A' ' 18' ' ' VAL . 44.7 mmm-85 . . . . . 0 C--O 1.241 0.63 0 CA-C-O 121.37 0.605 . . . . 0.0 110.887 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 15' ' ' VAL . 33.4 m . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.577 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.577 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.656 HG22 ' N ' ' A' ' 19' ' ' THR . 8.9 p -61.26 172.72 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.66 0.267 . . . . 0.0 110.417 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.656 ' N ' HG22 ' A' ' 18' ' ' VAL . 9.8 t -137.79 159.87 40.81 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 tp -139.23 129.3 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 121.313 0.578 . . . . 0.0 111.618 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.871 HH21 ' NE2' ' A' ' 10' ' ' GLN . 15.9 ptm180 -135.88 141.87 44.65 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.287 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -62.73 -36.17 82.14 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.43 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB3' ' NE ' ' A' ' 21' ' ' ARG . 21.9 ptmt 34.76 -151.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.267 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.427 0 O-C-N 120.052 -1.655 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . 0.459 ' N ' ' O ' ' A' ' 11' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.71 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.635 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 C--O 1.232 0.143 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 11' ' ' LYS . 7.4 p90 . . . . . 0 CA--C 1.504 -0.806 0 CA-C-O 121.418 0.628 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.417 HG21 HD13 ' A' ' 13' ' ' ILE . 26.0 pt . . . . . 0 C--O 1.227 -0.122 0 CA-C-O 123.004 1.383 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.895 ' N ' ' HG1' ' A' ' 19' ' ' THR . 21.3 tpp180 . . . . . 0 C--O 1.24 0.568 0 CA-C-O 121.704 0.764 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.698 HG13 ' O ' ' A' ' 15' ' ' VAL . 9.0 p . . . . . 0 CA--C 1.524 -0.048 0 CA-C-O 120.654 0.264 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.553 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.553 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.525 0.696 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 18' ' ' VAL . 57.4 t -84.18 34.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.564 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.895 ' HG1' ' N ' ' A' ' 14' ' ' ARG . 94.1 m -120.04 129.09 54.07 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.484 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 8.7 tp -167.3 154.66 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 118.076 -1.449 . . . . 0.0 114.015 -178.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.45 HH12 ' HA ' ' A' ' 10' ' ' GLN . 18.8 tpp180 -108.58 89.19 2.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 113.722 -1.581 . . . . 0.0 109.327 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 23' ' ' LYS . 17.9 tp10 -64.76 -39.16 93.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.351 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.596 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 23.4 tptm -8.7 123.58 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 124.664 1.186 . . . . 0.0 113.372 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.374 0 O-C-N 119.98 -1.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.662 HE22 ' CG ' ' A' ' 21' ' ' ARG . 14.1 mp0 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.638 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.552 0.215 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.615 HG23 ' HG3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.136 0.493 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.615 ' HG3' HG23 ' A' ' 13' ' ' ILE . 22.6 tpp180 . . . . . 0 C--O 1.237 0.412 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.572 ' N ' ' HG1' ' A' ' 19' ' ' THR . 64.2 t . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.834 0.826 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.464 ' O1 ' ' C ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.464 ' C ' ' O1 ' ' A' ' 16' ' ' 4FU . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.5 t -94.2 87.16 2.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.572 ' HG1' ' N ' ' A' ' 15' ' ' VAL . 67.1 m -152.85 152.54 31.67 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.751 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mm -134.67 134.25 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.836 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.662 ' CG ' HE22 ' A' ' 10' ' ' GLN . 13.7 tpt180 -172.34 165.8 5.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 8.3 mp0 -75.66 100.32 4.6 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.571 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -92.96 144.33 25.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.721 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.312 0 O-C-N 120.055 -1.653 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.727 ' N ' HH12 ' A' ' 21' ' ' ARG . 37.6 mt-30 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' HH12 ' A' ' 21' ' ' ARG . 14.2 mmmm . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.568 ' HD1' ' N ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 121.248 0.547 . . . . 0.0 111.723 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 N--CA 1.466 0.348 0 CA-C-O 121.37 0.605 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.9 ttm-85 . . . . . 0 C--O 1.24 0.575 0 CA-C-O 121.274 0.559 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.4 p . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.544 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.544 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.525 0.672 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -65.16 -178.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 120.88 0.371 . . . . 0.0 110.906 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.546 ' OG1' ' CZ ' ' A' ' 12' ' ' PHE . 10.1 t -143.25 152.42 41.69 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.677 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.429 HG22 ' CG2' ' A' ' 15' ' ' VAL . 12.6 tt -154.74 142.3 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.458 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.873 ' NE ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -170.29 -170.55 0.97 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.196 -179.556 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.592 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 4.9 mm-40 -58.95 -42.42 89.78 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.131 0.423 . . . . 0.0 112.04 -176.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.873 ' H ' ' NE ' ' A' ' 21' ' ' ARG . 24.4 ttmm 57.04 122.09 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 122.74 0.416 . . . . 0.0 110.777 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.326 0 O-C-N 119.834 -1.791 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.492 ' CD ' HH12 ' A' ' 21' ' ' ARG . 28.8 mm100 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' C ' ' O ' ' A' ' 12' ' ' PHE . 27.8 mtpp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.632 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 5.9 p90 . . . . . 0 N--CA 1.472 0.666 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.8 tt . . . . . 0 N--CA 1.468 0.457 0 CA-C-O 120.656 0.265 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.692 ' HG2' HG12 ' A' ' 15' ' ' VAL . 44.5 mmm-85 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 121.369 0.604 . . . . 0.0 111.899 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.692 HG12 ' HG2' ' A' ' 14' ' ' ARG . 48.3 t . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.607 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.607 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 18' ' ' VAL . 34.3 m -89.79 81.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 68.4 p -135.78 -177.59 4.75 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.373 -178.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.632 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 12.9 tt -141.65 161.36 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.737 ' HE ' ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -101.74 106.17 17.15 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.737 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 17.9 tp10 -86.09 -50.34 7.1 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.473 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.671 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 41.2 ttmt 22.45 86.9 0.01 OUTLIER 'General case' 0 C--N 1.343 0.32 0 O-C-N 123.655 0.597 . . . . 0.0 112.239 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.295 0 O-C-N 119.976 -1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . 0.628 ' N ' ' N ' ' A' ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.467 ' OE1' ' N ' ' A' ' 9' ' ' NH2 . 10.3 tm0? . . . . . 0 N--CA 1.429 -1.516 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.686 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 122.534 1.159 . . . . 0.0 112.944 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.446 ' CD1' ' C ' ' A' ' 12' ' ' PHE . 11.6 p90 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.647 ' N ' HD13 ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.711 0.767 . . . . 0.0 110.393 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.985 ' N ' ' HG1' ' A' ' 19' ' ' THR . 30.1 tpt180 . . . . . 0 C--O 1.243 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 15' ' ' VAL . 33.0 m . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 120.889 0.376 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.574 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.574 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.701 ' O ' HG12 ' A' ' 18' ' ' VAL . 58.8 t -88.19 28.32 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.247 0.546 . . . . 0.0 111.202 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.985 ' HG1' ' N ' ' A' ' 14' ' ' ARG . 96.9 m -120.26 122.46 40.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.395 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.42 HG13 ' N ' ' A' ' 21' ' ' ARG . 8.2 tp -172.2 161.75 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.385 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' N ' HG13 ' A' ' 20' ' ' ILE . 44.6 ttm180 -107.95 133.49 52.2 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-O 121.613 0.721 . . . . 0.0 110.954 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 176.35 -18.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.542 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -78.59 43.46 0.48 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.565 -1.652 . . . . 0.0 110.53 179.195 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . 0.628 ' N ' ' N ' ' A' ' 9' ' ' NH2 . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 120.055 -1.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . 0.708 ' N ' HE21 ' A' ' 10' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.788 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.612 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.498 ' O ' ' C ' ' A' ' 11' ' ' LYS . 9.9 p90 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.947 HG23 ' NH2' ' A' ' 21' ' ' ARG . 80.4 mt . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.685 0.279 . . . . 0.0 111.458 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.568 HH12 ' C ' ' A' ' 17' ' ' GLY . 67.8 mtm-85 . . . . . 0 C--O 1.243 0.732 0 CA-C-O 121.528 0.68 . . . . 0.0 112.6 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.5 p . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 120.708 0.29 . . . . 0.0 110.433 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.547 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.568 ' C ' HH12 ' A' ' 14' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.513 ' N ' HH12 ' A' ' 14' ' ' ARG . 34.1 m -129.4 159.98 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 120.816 0.341 . . . . 0.0 110.545 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.495 HG23 ' O ' ' A' ' 19' ' ' THR . 10.2 t -138.84 121.72 16.58 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.783 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -155.19 169.72 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 111.047 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 13' ' ' ILE . 20.8 tpp180 -162.34 167.31 24.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.192 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.53 ' H ' ' HD3' ' A' ' 21' ' ' ARG . 15.8 pt-20 -86.04 45.55 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.817 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.895 ' HZ3' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -38.27 -29.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.853 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . 0.417 ' N ' ' O ' ' A' ' 22' ' ' GLU . . . . . . . . 0 C--N 1.304 -1.381 0 O-C-N 120.033 -1.667 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.603 ' OE1' ' N ' ' A' ' 10' ' ' GLN . 15.3 mp0 . . . . . 0 N--CA 1.461 0.087 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.794 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.835 0.826 . . . . 0.0 112.963 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' O ' ' A' ' 11' ' ' LYS . 4.5 p90 . . . . . 0 N--CA 1.461 0.088 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.719 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.175 0.512 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.44 0 CA-C-O 120.956 0.407 . . . . 0.0 110.036 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.647 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.1 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.053 0.454 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.553 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.553 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.9 t -109.81 112.79 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.531 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 82.5 p -116.02 87.42 2.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.982 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.7 ' C ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 163.75 126.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 124.142 0.901 . . . . 0.0 110.67 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.794 ' HE ' ' N ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -160.16 173.96 14.99 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.447 176.4 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 21' ' ' ARG . 68.4 mm-40 21.95 44.23 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.214 0.605 . . . . 0.0 112.48 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -80.0 -3.17 47.26 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.268 0 O-C-N 119.993 -1.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.533 ' CB ' ' H ' ' A' ' 22' ' ' GLU . 34.9 tp60 . . . . . 0 N--CA 1.438 -1.046 0 CA-C-O 120.55 0.214 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.571 ' NZ ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.81 0.338 . . . . 0.0 111.491 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.584 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 16.0 p90 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.0 mt . . . . . 0 N--CA 1.467 0.406 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 121.052 0.454 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 67.4 t . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -86.86 171.41 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 t -163.46 176.7 9.52 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.314 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.584 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 48.5 mm -133.68 152.73 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.627 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -108.11 -178.56 3.64 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.812 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.533 ' H ' ' CB ' ' A' ' 10' ' ' GLN . 3.5 tm-20 71.36 -35.14 0.32 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.627 ' H ' ' C ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 5.58 115.23 0.0 OUTLIER 'General case' 0 C--N 1.341 0.235 0 C-N-CA 125.169 1.388 . . . . 0.0 111.793 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.333 0 O-C-N 119.973 -1.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.491 ' HG3' ' NE ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.561 0.219 . . . . 0.0 110.963 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 64.0 pttt . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.542 ' N ' ' CD1' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 13' ' ' ILE . 7.2 tp . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 121.798 0.809 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.667 ' N ' HG22 ' A' ' 15' ' ' VAL . 27.3 mmm180 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 121.381 0.61 . . . . 0.0 111.841 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.667 HG22 ' N ' ' A' ' 14' ' ' ARG . 7.6 p . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.352 0.12 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' 4FU . . . . . 0.617 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.617 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -99.6 92.62 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.499 ' OG1' ' CE2' ' A' ' 12' ' ' PHE . 82.6 p -134.78 165.94 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.668 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.765 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.84 152.28 12.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.298 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.634 ' NH1' ' HB2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -177.32 -171.19 0.32 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.299 0.571 . . . . 0.0 112.454 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' A' ' 24' ' ' NH2 . 4.7 mm-40 -95.81 -7.21 37.66 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.752 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.506 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 21.7 ptmt 29.7 34.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.957 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' NH2 . . . . . 0.501 ' N ' ' O ' ' A' ' 22' ' ' GLU . . . . . . . . 0 C--N 1.306 -1.306 0 O-C-N 119.968 -1.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.561 ' CD ' HH21 ' A' ' 21' ' ' ARG . 2.1 pp0? . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.469 0.176 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 12' ' ' PHE . 14.7 ptmm? . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CE1' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.671 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.14 0 CA-C-O 121.633 0.73 . . . . 0.0 110.76 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.434 ' N ' ' O ' ' A' ' 18' ' ' VAL . 44.7 mmm-85 . . . . . 0 C--O 1.241 0.63 0 CA-C-O 121.37 0.605 . . . . 0.0 110.887 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 15' ' ' VAL . 33.4 m . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.656 HG22 ' N ' ' A' ' 19' ' ' THR . 8.9 p -61.26 172.72 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.66 0.267 . . . . 0.0 110.417 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.656 ' N ' HG22 ' A' ' 18' ' ' VAL . 9.8 t -137.79 159.87 40.81 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 tp -139.23 129.3 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 121.313 0.578 . . . . 0.0 111.618 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.561 HH21 ' CD ' ' A' ' 10' ' ' GLN . 15.9 ptm180 -135.88 141.87 44.65 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.287 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -62.73 -36.17 82.14 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.43 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.49 ' HA ' HE22 ' A' ' 10' ' ' GLN . 21.9 ptmt . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.267 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.71 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.635 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 C--O 1.232 0.143 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 11' ' ' LYS . 7.4 p90 . . . . . 0 CA--C 1.504 -0.806 0 CA-C-O 121.418 0.628 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.417 HG21 HD13 ' A' ' 13' ' ' ILE . 26.0 pt . . . . . 0 C--O 1.227 -0.122 0 CA-C-O 123.004 1.383 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.451 ' N ' ' OG1' ' A' ' 19' ' ' THR . 21.3 tpp180 . . . . . 0 C--O 1.24 0.568 0 CA-C-O 121.704 0.764 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.812 ' N ' ' HG1' ' A' ' 19' ' ' THR . 9.0 p . . . . . 0 CA--C 1.524 -0.048 0 CA-C-O 120.654 0.264 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.696 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 18' ' ' VAL . 57.4 t -84.18 34.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.564 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.812 ' HG1' ' N ' ' A' ' 15' ' ' VAL . 94.1 m -120.04 129.09 54.07 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.484 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 8.7 tp -167.3 154.66 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 118.076 -1.449 . . . . 0.0 114.015 -178.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.45 HH12 ' HA ' ' A' ' 10' ' ' GLN . 18.8 tpp180 -108.58 89.19 2.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 113.722 -1.581 . . . . 0.0 109.327 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 23' ' ' LYS . 17.9 tp10 -64.76 -39.16 93.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.351 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.596 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 23.4 tptm . . . . . 0 N--CA 1.439 -0.997 0 C-N-CA 124.664 1.186 . . . . 0.0 113.372 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.662 HE22 ' CG ' ' A' ' 21' ' ' ARG . 14.1 mp0 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.638 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.552 0.215 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.615 HG23 ' HG3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.136 0.493 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.615 ' HG3' HG23 ' A' ' 13' ' ' ILE . 22.6 tpp180 . . . . . 0 C--O 1.237 0.412 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.556 ' N ' ' HG1' ' A' ' 19' ' ' THR . 64.2 t . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.834 0.826 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.5 t -94.2 87.16 2.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.556 ' HG1' ' N ' ' A' ' 15' ' ' VAL . 67.1 m -152.85 152.54 31.67 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.751 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mm -134.67 134.25 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.836 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.662 ' CG ' HE22 ' A' ' 10' ' ' GLN . 13.7 tpt180 -172.34 165.8 5.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 8.3 mp0 -75.66 100.32 4.6 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.571 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? . . . . . 0 C--N 1.332 -0.155 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.721 179.593 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.727 ' N ' HH12 ' A' ' 21' ' ' ARG . 70.6 mt-30 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' HH12 ' A' ' 21' ' ' ARG . 14.2 mmmm . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.568 ' HD1' ' N ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 121.248 0.547 . . . . 0.0 111.723 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 N--CA 1.466 0.348 0 CA-C-O 121.37 0.605 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.9 ttm-85 . . . . . 0 C--O 1.24 0.575 0 CA-C-O 121.274 0.559 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.4 p . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.672 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -65.16 -178.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 120.88 0.371 . . . . 0.0 110.906 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.546 ' OG1' ' CZ ' ' A' ' 12' ' ' PHE . 10.1 t -143.25 152.42 41.69 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.677 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.429 HG22 ' CG2' ' A' ' 15' ' ' VAL . 12.6 tt -154.74 142.3 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.458 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.873 ' NE ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -170.29 -170.55 0.97 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.196 -179.556 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.592 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 4.9 mm-40 -58.95 -42.42 89.78 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.131 0.423 . . . . 0.0 112.04 -176.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.873 ' H ' ' NE ' ' A' ' 21' ' ' ARG . 24.4 ttmm . . . . . 0 N--CA 1.439 -1.025 0 C-N-CA 122.74 0.416 . . . . 0.0 110.777 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.805 ' NE2' HH12 ' A' ' 21' ' ' ARG . 94.2 mm-40 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' C ' ' O ' ' A' ' 12' ' ' PHE . 27.8 mtpp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.632 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 5.9 p90 . . . . . 0 N--CA 1.472 0.666 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.8 tt . . . . . 0 N--CA 1.468 0.457 0 CA-C-O 120.656 0.265 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.692 ' HG2' HG12 ' A' ' 15' ' ' VAL . 44.5 mmm-85 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 121.369 0.604 . . . . 0.0 111.899 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.692 HG12 ' HG2' ' A' ' 14' ' ' ARG . 48.3 t . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 18' ' ' VAL . 34.3 m -89.79 81.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 68.4 p -135.78 -177.59 4.75 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.373 -178.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.632 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 12.9 tt -141.65 161.36 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.805 HH12 ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -101.74 106.17 17.15 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.737 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 17.9 tp10 -86.09 -50.34 7.1 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.473 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.671 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 41.2 ttmt . . . . . 0 C--N 1.343 0.32 0 O-C-N 123.655 0.597 . . . . 0.0 112.239 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.611 ' C ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.516 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.686 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 122.534 1.159 . . . . 0.0 112.944 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.446 ' CD1' ' C ' ' A' ' 12' ' ' PHE . 11.6 p90 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.647 ' N ' HD13 ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.711 0.767 . . . . 0.0 110.393 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.985 ' N ' ' HG1' ' A' ' 19' ' ' THR . 30.1 tpt180 . . . . . 0 C--O 1.243 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.607 HG23 ' O ' ' A' ' 15' ' ' VAL . 33.0 m . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 120.889 0.376 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.701 ' O ' HG12 ' A' ' 18' ' ' VAL . 58.8 t -88.19 28.32 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.247 0.546 . . . . 0.0 111.202 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.985 ' HG1' ' N ' ' A' ' 14' ' ' ARG . 96.9 m -120.26 122.46 40.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.395 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.42 HG13 ' N ' ' A' ' 21' ' ' ARG . 8.2 tp -172.2 161.75 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.385 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' N ' HG13 ' A' ' 20' ' ' ILE . 44.6 ttm180 -107.95 133.49 52.2 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-O 121.613 0.721 . . . . 0.0 110.954 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 176.35 -18.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.542 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.449 -0.515 0 CA-C-N 113.565 -1.652 . . . . 0.0 110.53 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.641 ' OE1' ' N ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.612 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.498 ' O ' ' C ' ' A' ' 11' ' ' LYS . 9.9 p90 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.947 HG23 ' NH2' ' A' ' 21' ' ' ARG . 80.4 mt . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.685 0.279 . . . . 0.0 111.458 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.568 HH12 ' C ' ' A' ' 17' ' ' GLY . 67.8 mtm-85 . . . . . 0 C--O 1.243 0.732 0 CA-C-O 121.528 0.68 . . . . 0.0 112.6 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.5 p . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 120.708 0.29 . . . . 0.0 110.433 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.568 ' C ' HH12 ' A' ' 14' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.513 ' N ' HH12 ' A' ' 14' ' ' ARG . 34.1 m -129.4 159.98 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 120.816 0.341 . . . . 0.0 110.545 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.495 HG23 ' O ' ' A' ' 19' ' ' THR . 10.2 t -138.84 121.72 16.58 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.783 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -155.19 169.72 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 111.047 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 13' ' ' ILE . 20.8 tpp180 -162.34 167.31 24.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.192 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.53 ' H ' ' HD3' ' A' ' 21' ' ' ARG . 15.8 pt-20 -86.04 45.55 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.817 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.904 ' HZ3' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.293 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.853 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.764 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.087 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.794 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.835 0.826 . . . . 0.0 112.963 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' O ' ' A' ' 11' ' ' LYS . 4.5 p90 . . . . . 0 N--CA 1.461 0.088 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.719 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.175 0.512 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.44 0 CA-C-O 120.956 0.407 . . . . 0.0 110.036 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.647 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.1 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.053 0.454 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.9 t -109.81 112.79 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.531 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 82.5 p -116.02 87.42 2.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.982 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.7 ' C ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 163.75 126.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 124.142 0.901 . . . . 0.0 110.67 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.794 ' HE ' ' N ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -160.16 173.96 14.99 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.447 176.4 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 21' ' ' ARG . 68.4 mm-40 21.95 44.23 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.214 0.605 . . . . 0.0 112.48 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.18 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.533 ' CB ' ' H ' ' A' ' 22' ' ' GLU . 2.6 tp-100 . . . . . 0 N--CA 1.438 -1.046 0 CA-C-O 120.55 0.214 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.571 ' NZ ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.81 0.338 . . . . 0.0 111.491 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.584 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 16.0 p90 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.0 mt . . . . . 0 N--CA 1.467 0.406 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 121.052 0.454 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 67.4 t . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -86.86 171.41 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 t -163.46 176.7 9.52 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.314 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.584 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 48.5 mm -133.68 152.73 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.627 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -108.11 -178.56 3.64 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.812 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.533 ' H ' ' CB ' ' A' ' 10' ' ' GLN . 3.5 tm-20 71.36 -35.14 0.32 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.627 ' H ' ' C ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER . . . . . 0 C--N 1.341 0.235 0 C-N-CA 125.169 1.388 . . . . 0.0 111.793 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.786 HE21 ' HE ' ' A' ' 21' ' ' ARG . 1.9 pp0? . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.561 0.219 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 64.0 pttt . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.542 ' N ' ' CD1' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 13' ' ' ILE . 7.2 tp . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 121.798 0.809 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.667 ' N ' HG22 ' A' ' 15' ' ' VAL . 27.3 mmm180 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 121.381 0.61 . . . . 0.0 111.841 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.667 HG22 ' N ' ' A' ' 14' ' ' ARG . 7.6 p . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.352 0.12 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -99.6 92.62 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.499 ' OG1' ' CE2' ' A' ' 12' ' ' PHE . 82.6 p -134.78 165.94 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.668 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.765 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.84 152.28 12.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.298 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.786 ' HE ' HE21 ' A' ' 10' ' ' GLN . 0.3 OUTLIER -177.32 -171.19 0.32 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.299 0.571 . . . . 0.0 112.454 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 23' ' ' LYS . 4.7 mm-40 -95.81 -7.21 37.66 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.752 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.506 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 21.7 ptmt . . . . . 0 N--CA 1.462 0.17 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.957 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.561 ' CD ' HH21 ' A' ' 21' ' ' ARG . 2.1 pp0? . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.469 0.176 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 12' ' ' PHE . 14.7 ptmm? . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CE1' ' OG1' ' A' ' 19' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.11 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.671 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.462 0.14 0 CA-C-O 121.633 0.73 . . . . 0.0 110.76 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.434 ' N ' ' O ' ' A' ' 18' ' ' VAL . 44.7 mmm-85 . . . . . 0 C--O 1.241 0.63 0 CA-C-O 121.37 0.605 . . . . 0.0 110.887 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 15' ' ' VAL . 33.4 m . . . . . 0 N--CA 1.47 0.539 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.577 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.577 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.526 0.735 0 N-CA-C 111.191 -0.763 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.656 HG22 ' N ' ' A' ' 19' ' ' THR . 8.9 p -61.26 172.72 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.66 0.267 . . . . 0.0 110.417 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.656 ' N ' HG22 ' A' ' 18' ' ' VAL . 9.8 t -137.79 159.87 40.81 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 tp -139.23 129.3 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-O 121.313 0.578 . . . . 0.0 111.618 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.561 HH21 ' CD ' ' A' ' 10' ' ' GLN . 15.9 ptm180 -135.88 141.87 44.65 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.287 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -62.73 -36.17 82.14 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.058 -0.973 . . . . 0.0 108.43 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' HA ' HE22 ' A' ' 10' ' ' GLN . 21.9 ptmt 34.76 -151.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.267 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.427 0 O-C-N 120.052 -1.655 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . 0.459 ' N ' ' O ' ' A' ' 11' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.71 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.635 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 C--O 1.232 0.143 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.633 ' CD1' ' N ' ' A' ' 11' ' ' LYS . 7.4 p90 . . . . . 0 CA--C 1.504 -0.806 0 CA-C-O 121.418 0.628 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.417 HG21 HD13 ' A' ' 13' ' ' ILE . 26.0 pt . . . . . 0 C--O 1.227 -0.122 0 CA-C-O 123.004 1.383 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.895 ' N ' ' HG1' ' A' ' 19' ' ' THR . 21.3 tpp180 . . . . . 0 C--O 1.24 0.568 0 CA-C-O 121.704 0.764 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.698 HG13 ' O ' ' A' ' 15' ' ' VAL . 9.0 p . . . . . 0 CA--C 1.524 -0.048 0 CA-C-O 120.654 0.264 . . . . 0.0 110.441 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.553 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.553 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.525 0.696 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 18' ' ' VAL . 57.4 t -84.18 34.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.4 0.619 . . . . 0.0 110.564 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.895 ' HG1' ' N ' ' A' ' 14' ' ' ARG . 94.1 m -120.04 129.09 54.07 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.484 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 8.7 tp -167.3 154.66 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 118.076 -1.449 . . . . 0.0 114.015 -178.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.45 HH12 ' HA ' ' A' ' 10' ' ' GLN . 18.8 tpp180 -108.58 89.19 2.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 113.722 -1.581 . . . . 0.0 109.327 178.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' C ' ' A' ' 23' ' ' LYS . 17.9 tp10 -64.76 -39.16 93.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.351 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.596 ' N ' ' OE1' ' A' ' 10' ' ' GLN . 23.4 tptm -8.7 123.58 0.01 OUTLIER 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 124.664 1.186 . . . . 0.0 113.372 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.374 0 O-C-N 119.98 -1.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.662 HE22 ' CG ' ' A' ' 21' ' ' ARG . 14.1 mp0 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.638 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 5.0 ttpm? . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.552 0.215 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.615 HG23 ' HG3' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.136 0.493 . . . . 0.0 111.394 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.615 ' HG3' HG23 ' A' ' 13' ' ' ILE . 22.6 tpp180 . . . . . 0 C--O 1.237 0.412 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.572 ' N ' ' HG1' ' A' ' 19' ' ' THR . 64.2 t . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 121.834 0.826 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.464 ' O1 ' ' C ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.464 ' C ' ' O1 ' ' A' ' 16' ' ' 4FU . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.5 t -94.2 87.16 2.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.572 ' HG1' ' N ' ' A' ' 15' ' ' VAL . 67.1 m -152.85 152.54 31.67 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.751 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 48.5 mm -134.67 134.25 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.836 -178.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.662 ' CG ' HE22 ' A' ' 10' ' ' GLN . 13.7 tpt180 -172.34 165.8 5.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 8.3 mp0 -75.66 100.32 4.6 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.571 -178.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.8 ptpp? -92.96 144.33 25.37 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.721 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.312 0 O-C-N 120.055 -1.653 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.727 ' N ' HH12 ' A' ' 21' ' ' ARG . 70.6 mt-30 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' HH12 ' A' ' 21' ' ' ARG . 14.2 mmmm . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.568 ' HD1' ' N ' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 121.248 0.547 . . . . 0.0 111.723 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 N--CA 1.466 0.348 0 CA-C-O 121.37 0.605 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 49.9 ttm-85 . . . . . 0 C--O 1.24 0.575 0 CA-C-O 121.274 0.559 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.4 p . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.544 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.544 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.525 0.672 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -65.16 -178.17 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 120.88 0.371 . . . . 0.0 110.906 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.546 ' OG1' ' CZ ' ' A' ' 12' ' ' PHE . 10.1 t -143.25 152.42 41.69 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.677 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.429 HG22 ' CG2' ' A' ' 15' ' ' VAL . 12.6 tt -154.74 142.3 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.458 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.873 ' NE ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -170.29 -170.55 0.97 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.196 -179.556 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.592 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 4.9 mm-40 -58.95 -42.42 89.78 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 118.131 0.423 . . . . 0.0 112.04 -176.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.873 ' H ' ' NE ' ' A' ' 21' ' ' ARG . 24.4 ttmm 57.04 122.09 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 122.74 0.416 . . . . 0.0 110.777 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . 0.683 ' N ' HE22 ' A' ' 10' ' ' GLN . . . . . . . . 0 C--N 1.305 -1.326 0 O-C-N 119.834 -1.791 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.805 ' NE2' HH12 ' A' ' 21' ' ' ARG . 94.2 mm-40 . . . . . 0 N--CA 1.462 0.158 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' C ' ' O ' ' A' ' 12' ' ' PHE . 27.8 mtpp . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.632 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 5.9 p90 . . . . . 0 N--CA 1.472 0.666 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.8 tt . . . . . 0 N--CA 1.468 0.457 0 CA-C-O 120.656 0.265 . . . . 0.0 110.379 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.692 ' HG2' HG12 ' A' ' 15' ' ' VAL . 44.5 mmm-85 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 121.369 0.604 . . . . 0.0 111.899 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.692 HG12 ' HG2' ' A' ' 14' ' ' ARG . 48.3 t . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.607 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.607 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 18' ' ' VAL . 34.3 m -89.79 81.0 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 68.4 p -135.78 -177.59 4.75 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.373 -178.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.632 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 12.9 tt -141.65 161.36 21.26 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 -178.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.805 HH12 ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -101.74 106.17 17.15 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.737 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 17.9 tp10 -86.09 -50.34 7.1 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.473 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.671 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 41.2 ttmt 22.45 86.9 0.01 OUTLIER 'General case' 0 C--N 1.343 0.32 0 O-C-N 123.655 0.597 . . . . 0.0 112.239 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.295 0 O-C-N 119.976 -1.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . 0.628 ' N ' ' N ' ' A' ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.618 ' NE2' ' N ' ' A' ' 9' ' ' NH2 . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.516 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.686 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 122.534 1.159 . . . . 0.0 112.944 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.446 ' C ' ' CD1' ' A' ' 12' ' ' PHE . 11.6 p90 . . . . . 0 CA--C 1.521 -0.173 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.647 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.711 0.767 . . . . 0.0 110.393 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.985 ' N ' ' HG1' ' A' ' 19' ' ' THR . 30.1 tpt180 . . . . . 0 C--O 1.243 0.715 0 CA-C-O 121.668 0.747 . . . . 0.0 110.738 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.607 ' O ' HG23 ' A' ' 15' ' ' VAL . 33.0 m . . . . . 0 N--CA 1.471 0.587 0 CA-C-O 120.889 0.376 . . . . 0.0 110.31 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.574 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.574 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 N--CA 1.47 0.902 0 N-CA-C 111.564 -0.615 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.701 HG12 ' O ' ' A' ' 18' ' ' VAL . 58.8 t -88.19 28.32 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.247 0.546 . . . . 0.0 111.202 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.985 ' HG1' ' N ' ' A' ' 14' ' ' ARG . 96.9 m -120.26 122.46 40.93 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.395 178.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.42 HG13 ' N ' ' A' ' 21' ' ' ARG . 8.2 tp -172.2 161.75 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 119.173 -1.011 . . . . 0.0 112.385 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' N ' HG13 ' A' ' 20' ' ' ILE . 44.6 ttm180 -107.95 133.49 52.2 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-O 121.613 0.721 . . . . 0.0 110.954 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 176.35 -18.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 106.32 -1.733 . . . . 0.0 106.32 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.542 ' HD2' ' N ' ' A' ' 23' ' ' LYS . 0.4 OUTLIER -78.59 43.46 0.48 Allowed 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.565 -1.652 . . . . 0.0 110.53 179.195 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . 0.628 ' N ' ' N ' ' A' ' 9' ' ' NH2 . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 120.055 -1.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.641 ' OE1' ' N ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.612 ' NZ ' ' HB3' ' A' ' 11' ' ' LYS . 6.6 mtpm? . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.498 ' O ' ' C ' ' A' ' 11' ' ' LYS . 9.9 p90 . . . . . 0 C--O 1.232 0.132 0 N-CA-C 111.579 0.215 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.947 HG23 ' NH2' ' A' ' 21' ' ' ARG . 80.4 mt . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.685 0.279 . . . . 0.0 111.458 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.568 HH12 ' C ' ' A' ' 17' ' ' GLY . 67.8 mtm-85 . . . . . 0 C--O 1.243 0.732 0 CA-C-O 121.528 0.68 . . . . 0.0 112.6 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.453 HG13 ' O ' ' A' ' 15' ' ' VAL . 8.5 p . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 120.708 0.29 . . . . 0.0 110.433 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.547 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.568 ' C ' HH12 ' A' ' 14' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.513 ' N ' HH12 ' A' ' 14' ' ' ARG . 34.1 m -129.4 159.98 40.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 120.816 0.341 . . . . 0.0 110.545 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.495 HG23 ' O ' ' A' ' 19' ' ' THR . 10.2 t -138.84 121.72 16.58 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.783 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -155.19 169.72 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 120.87 0.367 . . . . 0.0 111.047 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.947 ' NH2' HG23 ' A' ' 13' ' ' ILE . 20.8 tpp180 -162.34 167.31 24.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.192 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.53 ' H ' ' HD3' ' A' ' 21' ' ' ARG . 15.8 pt-20 -86.04 45.55 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.817 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.904 ' HZ3' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -38.27 -29.77 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.853 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . 0.417 ' N ' ' O ' ' A' ' 22' ' ' GLU . . . . . . . . 0 C--N 1.304 -1.381 0 O-C-N 120.033 -1.667 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.764 ' N ' ' NE2' ' A' ' 10' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.087 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.794 ' N ' ' HE ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.835 0.826 . . . . 0.0 112.963 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.59 ' O ' ' O ' ' A' ' 11' ' ' LYS . 4.5 p90 . . . . . 0 N--CA 1.461 0.088 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.719 HD13 ' N ' ' A' ' 13' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 121.175 0.512 . . . . 0.0 111.472 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.561 ' N ' ' HD2' ' A' ' 14' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.44 0 CA-C-O 120.956 0.407 . . . . 0.0 110.036 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.647 ' O ' HG23 ' A' ' 15' ' ' VAL . 34.1 m . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 121.053 0.454 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.553 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.553 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.526 0.73 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.9 t -109.81 112.79 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.531 ' O ' ' HB ' ' A' ' 20' ' ' ILE . 82.5 p -116.02 87.42 2.67 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.982 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.7 ' C ' HD13 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 163.75 126.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 O-C-N 124.142 0.901 . . . . 0.0 110.67 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.794 ' HE ' ' N ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -160.16 173.96 14.99 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.447 176.4 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.45 ' C ' ' O ' ' A' ' 21' ' ' ARG . 68.4 mm-40 21.95 44.23 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.214 0.605 . . . . 0.0 112.48 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.529 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -80.0 -3.17 47.26 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.307 -1.268 0 O-C-N 119.993 -1.692 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.533 ' CB ' ' H ' ' A' ' 22' ' ' GLU . 2.6 tp-100 . . . . . 0 N--CA 1.438 -1.046 0 CA-C-O 120.55 0.214 . . . . 0.0 110.465 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.571 ' NZ ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.637 0 CA-C-O 120.81 0.338 . . . . 0.0 111.491 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.584 ' CZ ' ' O ' ' A' ' 20' ' ' ILE . 16.0 p90 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.0 mt . . . . . 0 N--CA 1.467 0.406 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 121.052 0.454 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 67.4 t . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 m -86.86 171.41 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 t -163.46 176.7 9.52 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.314 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.584 ' O ' ' CZ ' ' A' ' 12' ' ' PHE . 48.5 mm -133.68 152.73 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.627 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -108.11 -178.56 3.64 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.812 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.533 ' H ' ' CB ' ' A' ' 10' ' ' GLN . 3.5 tm-20 71.36 -35.14 0.32 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -178.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.627 ' H ' ' C ' ' A' ' 21' ' ' ARG . 1.0 OUTLIER 5.58 115.23 0.0 OUTLIER 'General case' 0 C--N 1.341 0.235 0 C-N-CA 125.169 1.388 . . . . 0.0 111.793 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.333 0 O-C-N 119.973 -1.704 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.786 HE21 ' HE ' ' A' ' 21' ' ' ARG . 1.9 pp0? . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.561 0.219 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 64.0 pttt . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.542 ' N ' ' CD1' ' A' ' 12' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 N-CA-C 109.527 -0.545 . . . . 0.0 109.527 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 13' ' ' ILE . 7.2 tp . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 121.798 0.809 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.667 ' N ' HG22 ' A' ' 15' ' ' VAL . 27.3 mmm180 . . . . . 0 C--O 1.245 0.822 0 CA-C-O 121.381 0.61 . . . . 0.0 111.841 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.667 HG22 ' N ' ' A' ' 14' ' ' ARG . 7.6 p . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 120.352 0.12 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' 4FU . . . . . 0.617 ' OAB' ' N ' ' A' ' 17' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.617 ' N ' ' OAB' ' A' ' 16' ' ' 4FU . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 109.852 -1.299 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -99.6 92.62 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.499 ' OG1' ' CE2' ' A' ' 12' ' ' PHE . 82.6 p -134.78 165.94 24.12 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.668 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.765 ' N ' HD13 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -148.84 152.28 12.33 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.11 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.298 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.786 ' HE ' HE21 ' A' ' 10' ' ' GLN . 0.3 OUTLIER -177.32 -171.19 0.32 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.299 0.571 . . . . 0.0 112.454 -179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.501 ' O ' ' N ' ' A' ' 24' ' ' NH2 . 4.7 mm-40 -95.81 -7.21 37.66 Favored 'General case' 0 C--N 1.345 0.407 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.752 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.506 ' H ' ' HG3' ' A' ' 21' ' ' ARG . 21.7 ptmt 29.7 34.7 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.957 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' NH2 . . . . . 0.501 ' N ' ' O ' ' A' ' 22' ' ' GLU . . . . . . . . 0 C--N 1.306 -1.306 0 O-C-N 119.968 -1.707 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_