data_1id6_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 1id6 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.5 ' O ' ' CD1' ' A' ' 12' ' ' LEU . 57.8 m . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.768 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 61.1 t 63.55 -103.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-O 116.341 -1.79 . . . . 0.0 107.739 -162.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.918 ' CB ' ' CD1' ' A' ' 6' ' ' TRP . 1.3 mt-30 -164.17 -36.26 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.975 -0.453 . . . . 0.0 110.088 162.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.64 ' HB1' ' CD1' ' A' ' 12' ' ' LEU . . . 53.14 -176.35 0.03 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.578 -175.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.475 ' HD2' ' C ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 48.16 27.17 1.2 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -170.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.918 ' CD1' ' CB ' ' A' ' 3' ' ' GLN . 0.0 OUTLIER -162.29 -154.32 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.7 -162.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CD2' ' A' ' 6' ' ' TRP . 44.4 tt0 -32.51 96.01 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.115 -0.366 . . . . 0.0 110.842 -164.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 57.81 -92.95 0.04 OUTLIER 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 -170.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.516 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 170.39 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.613 ' CD2' ' CG2' ' A' ' 2' ' ' VAL . 1.6 t80 -65.71 -53.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 t70 175.9 -30.49 0.0 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.64 ' CD1' ' HB1' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -82.26 12.43 4.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 117.569 -1.205 . . . . 0.0 110.177 178.542 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.625 ' N ' ' CB ' ' A' ' 4' ' ' ALA . 20.7 t0 . . . . . 0 N--CA 1.453 -0.317 0 O-C-N 121.37 -0.831 . . . . 0.0 109.849 166.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.51 ' O ' ' CD1' ' A' ' 12' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 118.801 -0.619 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.765 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 62.3 t 39.32 -107.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 117.616 -1.183 . . . . 0.0 109.152 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.647 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -159.23 -33.57 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 166.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.619 ' HB3' ' CG ' ' A' ' 12' ' ' LEU . . . 60.83 -179.95 0.1 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.229 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.593 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.77 43.47 0.1 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 118.943 -1.103 . . . . 0.0 108.029 -175.745 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -154.09 -151.59 0.37 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.543 -166.046 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.1 mt-10 -38.3 -81.18 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -172.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.497 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -131.22 87.9 2.53 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.625 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . -41.02 156.13 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.93 -165.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.497 ' CD2' ' O ' ' A' ' 8' ' ' ALA . 29.9 m-85 -142.41 -87.88 0.15 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.649 -167.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.574 ' C ' ' CD2' ' A' ' 12' ' ' LEU . 1.4 m-20 -85.49 7.32 23.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.031 -167.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.619 ' CG ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -142.97 -48.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -176.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.513 ' HA ' ' CB ' ' A' ' 9' ' ' ALA . 25.5 t70 . . . . . 0 N--CA 1.453 -0.32 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.38 173.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.567 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 3.2 p . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.568 HG12 ' CZ2' ' A' ' 6' ' ' TRP . 57.9 t -73.84 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 171.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.638 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -133.52 -39.87 0.89 Allowed 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.201 -1.036 . . . . 0.0 108.201 165.573 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.672 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 51.36 -175.11 0.02 OUTLIER 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.849 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.589 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 37.15 42.23 0.26 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 -170.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.672 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -156.45 -149.06 0.24 Allowed 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.103 -165.709 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.8 tp10 -50.81 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -170.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.437 ' N ' ' HG3' ' A' ' 7' ' ' GLU . . . -100.33 81.87 2.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.589 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . -41.12 147.6 0.13 Allowed 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -168.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CD2' HG13 ' A' ' 2' ' ' VAL . 1.9 m-85 -119.32 -86.2 0.65 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.238 -167.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.415 ' HB3' HD21 ' A' ' 12' ' ' LEU . 9.8 t0 -111.27 -17.01 13.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.868 -167.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.585 ' CG ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -98.13 -38.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 172.295 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.516 ' HA ' ' CB ' ' A' ' 9' ' ' ALA . 2.0 p-10 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.706 170.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.507 ' CB ' HD21 ' A' ' 12' ' ' LEU . 2.4 p . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.564 ' CG1' ' CH2' ' A' ' 6' ' ' TRP . 1.5 t -93.22 -79.43 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 118.632 -0.699 . . . . 0.0 110.176 -166.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.596 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 2.5 tp60 -145.59 -35.51 0.3 Allowed 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 167.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.588 ' O ' ' CD ' ' A' ' 5' ' ' ARG . . . 65.09 179.35 0.19 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 116.01 -1.948 . . . . 0.0 108.62 -172.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.588 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 31.72 40.13 0.01 OUTLIER 'General case' 0 C--N 1.35 0.626 0 O-C-N 120.238 -1.539 . . . . 0.0 108.717 178.716 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.596 ' CE3' ' CB ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -142.68 -153.3 0.46 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 118.592 -0.718 . . . . 0.0 110.751 -166.107 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.582 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 1.4 pp20? -33.99 -31.3 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -172.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -168.0 -76.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.357 169.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.514 ' HB2' ' CB ' ' A' ' 13' ' ' ASP . . . 159.94 142.74 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.225 164.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.431 ' HB3' HG21 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -126.54 -95.84 0.44 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.08 -164.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.66 14.77 23.78 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.174 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.544 HD13 ' N ' ' A' ' 2' ' ' VAL . 54.4 mt -130.01 -62.52 0.94 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -172.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.54 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 60.7 t0 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.324 171.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.638 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 49.2 p . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.684 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 56.2 t -83.86 -92.94 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.016 168.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.602 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -146.22 -45.1 0.2 Allowed 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 165.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.658 ' CA ' ' CD1' ' A' ' 6' ' ' TRP . . . 55.15 -171.24 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.253 -173.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.59 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.69 35.66 0.02 OUTLIER 'General case' 0 C--N 1.35 0.627 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -174.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.684 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.2 OUTLIER -147.82 -148.34 0.25 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.696 -167.467 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.427 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 11.2 mt-10 -36.61 -29.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -170.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.453 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -169.44 -68.61 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.905 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.508 ' HB1' ' CG ' ' A' ' 13' ' ' ASP . . . 159.61 120.17 0.0 OUTLIER 'General case' 0 C--O 1.235 0.307 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.653 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.532 ' CD1' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -131.44 -71.78 0.56 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.227 -0.589 . . . . 0.0 111.13 -161.468 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.618 ' HB2' ' CG2' ' A' ' 2' ' ' VAL . 0.5 OUTLIER -110.74 20.68 17.36 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.924 -0.485 . . . . 0.0 109.706 -169.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.638 ' CD2' ' HA ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -172.51 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.473 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.508 ' CG ' ' HB1' ' A' ' 9' ' ' ALA . 11.8 t0 . . . . . 0 N--CA 1.455 -0.225 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.432 167.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.436 ' HA ' HD23 ' A' ' 12' ' ' LEU . 61.7 p . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.746 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 55.0 t 37.91 -100.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 118.513 -0.756 . . . . 0.0 109.406 171.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.644 ' HB3' ' CG ' ' A' ' 6' ' ' TRP . 3.4 tp60 -157.3 -61.34 0.09 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 171.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.499 ' CB ' ' HG ' ' A' ' 12' ' ' LEU . . . 76.99 -15.38 0.74 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.975 161.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.614 ' N ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -98.94 40.07 1.23 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 162.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.746 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -141.85 -145.25 0.17 Allowed 'General case' 0 C--N 1.349 0.581 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.162 -153.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.512 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.4 tm-20 -35.72 -31.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.928 -0.483 . . . . 0.0 110.077 -165.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.436 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -163.63 -75.86 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.34 170.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.514 ' CB ' ' HB2' ' A' ' 13' ' ' ASP . . . 175.63 133.77 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.404 163.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.731 ' CD2' ' CG2' ' A' ' 2' ' ' VAL . 88.4 t80 -112.53 -92.67 0.47 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.561 -164.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.569 ' HB3' ' CD2' ' A' ' 10' ' ' PHE . 6.5 p-10 -101.4 -14.72 17.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -169.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HG ' ' CB ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -104.68 -75.1 0.63 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.514 ' HB2' ' CB ' ' A' ' 9' ' ' ALA . 10.0 t0 . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 171.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.505 ' O ' ' CD1' ' A' ' 12' ' ' LEU . 1.5 m . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.765 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 76.4 t 38.63 -110.13 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.64 164.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -166.83 -31.41 0.03 OUTLIER 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 169.219 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.69 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.95 174.43 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.027 173.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 42.25 47.97 4.2 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -165.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -162.16 -148.46 0.14 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.022 -164.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.9 tp10 -36.69 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -168.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.438 ' O ' ' CB ' ' A' ' 9' ' ' ALA . . . -105.57 -93.67 0.36 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.333 166.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.5 ' CB ' ' HB2' ' A' ' 13' ' ' ASP . . . 164.97 160.99 0.02 OUTLIER 'General case' 0 C--N 1.34 0.188 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 161.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CD2' ' CG2' ' A' ' 2' ' ' VAL . 8.8 m-85 -130.4 -84.69 0.53 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.272 -176.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.623 ' C ' ' CD2' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -135.93 28.61 3.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.23 -167.26 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.623 ' CD2' ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -160.42 30.98 0.16 Allowed 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 176.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.559 ' HA ' ' N ' ' A' ' 5' ' ' ARG . 52.6 t0 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.424 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.418 ' HA ' HD22 ' A' ' 12' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 119.41 -0.328 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.701 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 44.4 t -69.04 -99.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 117.671 -1.157 . . . . 0.0 108.719 167.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.614 ' CA ' HD13 ' A' ' 12' ' ' LEU . 2.9 tp-100 -170.74 -36.21 0.02 OUTLIER 'General case' 0 C--O 1.235 0.312 0 CA-C-O 118.58 -0.724 . . . . 0.0 109.139 166.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.539 ' HB1' ' N ' ' A' ' 13' ' ' ASP . . . 81.1 -62.88 0.19 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.073 168.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.461 ' H ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -78.7 63.92 3.58 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 116.342 -1.79 . . . . 0.0 106.853 174.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.701 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.0 OUTLIER -164.87 -148.51 0.11 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.482 -155.261 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.0 mm-40 -44.33 -96.8 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.501 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -125.45 93.14 3.77 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.22 -0.895 . . . . 0.0 108.78 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.499 ' CB ' ' HA ' ' A' ' 13' ' ' ASP . . . -36.9 148.23 0.03 OUTLIER 'General case' 0 C--N 1.339 0.132 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -162.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.501 ' CD2' ' O ' ' A' ' 8' ' ' ALA . 6.8 m-85 -129.03 -83.92 0.57 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.493 -167.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -105.21 -40.91 5.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.862 -167.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.757 ' CD2' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -72.88 -54.08 9.7 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 167.813 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.539 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.919 170.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.44 ' HA ' HD23 ' A' ' 12' ' ' LEU . 58.6 m . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.756 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 90.7 t -68.6 -100.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 117.535 -1.221 . . . . 0.0 108.881 167.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.642 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -159.55 -35.66 0.06 Allowed 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 165.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.763 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.29 173.56 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.949 176.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.591 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 45.04 49.81 9.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 -165.093 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.763 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -165.83 -148.71 0.1 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.091 -163.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -35.67 -71.07 0.08 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.314 -0.374 . . . . 0.0 110.046 -167.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.446 ' O ' ' CB ' ' A' ' 9' ' ' ALA . . . -111.05 -93.26 0.45 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.087 164.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.452 ' CB ' ' OD2' ' A' ' 13' ' ' ASP . . . 163.97 151.57 0.02 OUTLIER 'General case' 0 C--N 1.339 0.115 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.858 160.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.634 ' CD1' ' CG1' ' A' ' 2' ' ' VAL . 14.0 m-85 -109.56 -60.27 1.8 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.201 -170.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -164.59 -40.96 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.61 -167.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.61 HD11 ' CA ' ' A' ' 3' ' ' GLN . 0.2 OUTLIER -85.61 25.53 1.05 Allowed 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.562 ' HA ' ' N ' ' A' ' 5' ' ' ARG . 22.9 t0 . . . . . 0 C--N 1.342 0.243 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.78 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.644 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 46.2 m . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.614 ' CG2' ' HB3' ' A' ' 10' ' ' PHE . 1.5 t -129.82 -77.96 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.415 170.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 1.1 tp-100 -151.86 -50.64 0.11 Allowed 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 164.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.584 ' O ' ' CD ' ' A' ' 5' ' ' ARG . . . 70.9 -179.86 0.23 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 48.83 28.93 2.08 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -174.037 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.64 ' CE3' ' CB ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -155.43 -149.84 0.28 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.356 -160.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.506 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.6 mm-40 -38.59 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 43.87 -97.8 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -166.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.549 ' CB ' ' CG ' ' A' ' 13' ' ' ASP . . . -177.05 140.46 0.3 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.358 165.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.614 ' HB3' ' CG2' ' A' ' 2' ' ' VAL . 3.4 m-85 -104.35 -91.83 0.37 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.397 -164.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.469 ' C ' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -104.81 -12.62 16.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -170.408 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.69 ' CD2' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -111.0 -66.73 1.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.576 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.549 ' CG ' ' CB ' ' A' ' 9' ' ' ALA . 46.9 t0 . . . . . 0 N--CA 1.453 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.773 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' SER . . . . . 0.638 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 2.2 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' VAL . . . . . 0.754 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 88.1 t 31.86 -101.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 117.261 -1.352 . . . . 0.0 108.945 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -160.43 -41.08 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 164.688 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . 0.841 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 49.51 171.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.797 177.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 52.95 47.36 24.82 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -165.537 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.841 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -174.03 -151.76 0.05 OUTLIER 'General case' 0 C--N 1.348 0.51 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.853 -160.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.604 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 2.1 mt-10 -41.47 97.02 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -170.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.424 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 51.42 -94.25 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -165.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.424 ' N ' ' O ' ' A' ' 7' ' ' GLU . . . 174.19 134.58 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 167.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.658 ' CD1' ' CG1' ' A' ' 2' ' ' VAL . 0.5 OUTLIER -83.56 -75.65 0.32 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.779 -167.428 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' ' C ' ' A' ' 12' ' ' LEU . 32.6 t70 -141.83 -77.71 0.27 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.793 -173.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.638 ' CD2' ' HA ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -40.05 -41.09 1.17 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 174.077 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.514 ' HA ' ' CB ' ' A' ' 4' ' ' ALA . 6.5 t70 . . . . . 0 N--CA 1.452 -0.365 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.484 177.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.5 ' O ' ' CD1' ' A' ' 12' ' ' LEU . 57.8 m . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.768 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 61.1 t 63.55 -103.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-O 116.341 -1.79 . . . . 0.0 107.739 -162.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.918 ' CB ' ' CD1' ' A' ' 6' ' ' TRP . 1.3 mt-30 -164.17 -36.26 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.975 -0.453 . . . . 0.0 110.088 162.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.64 ' HB1' ' CD1' ' A' ' 12' ' ' LEU . . . 53.14 -176.35 0.03 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.578 -175.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.475 ' HD2' ' C ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 48.16 27.17 1.2 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -170.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.918 ' CD1' ' CB ' ' A' ' 3' ' ' GLN . 0.0 OUTLIER -162.29 -154.32 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.7 -162.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CD2' ' A' ' 6' ' ' TRP . 44.4 tt0 -32.51 96.01 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.115 -0.366 . . . . 0.0 110.842 -164.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 57.81 -92.95 0.04 OUTLIER 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 -170.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.516 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 170.39 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.613 ' CD2' ' CG2' ' A' ' 2' ' ' VAL . 1.6 t80 -65.71 -53.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 t70 175.9 -30.49 0.0 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.64 ' CD1' ' HB1' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -82.26 12.43 4.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 117.569 -1.205 . . . . 0.0 110.177 178.542 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.625 ' N ' ' CB ' ' A' ' 4' ' ' ALA . 20.7 t0 -63.89 -5.51 4.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.37 -0.831 . . . . 0.0 109.849 166.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.523 ' N ' HD23 ' A' ' 14' ' ' LEU . 5.1 mt 59.8 78.82 0.25 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.781 177.008 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.51 ' O ' ' CD1' ' A' ' 12' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 118.801 -0.619 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.765 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 62.3 t 39.32 -107.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 117.616 -1.183 . . . . 0.0 109.152 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.647 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -159.23 -33.57 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 166.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.619 ' HB3' ' CG ' ' A' ' 12' ' ' LEU . . . 60.83 -179.95 0.1 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.229 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.593 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.77 43.47 0.1 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 118.943 -1.103 . . . . 0.0 108.029 -175.745 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -154.09 -151.59 0.37 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.543 -166.046 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.1 mt-10 -38.3 -81.18 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -172.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.497 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -131.22 87.9 2.53 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.625 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . -41.02 156.13 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.93 -165.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.497 ' CD2' ' O ' ' A' ' 8' ' ' ALA . 29.9 m-85 -142.41 -87.88 0.15 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.649 -167.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.574 ' C ' ' CD2' ' A' ' 12' ' ' LEU . 1.4 m-20 -85.49 7.32 23.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.031 -167.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.619 ' CG ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -142.97 -48.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -176.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.575 ' O ' ' CD1' ' A' ' 14' ' ' LEU . 25.5 t70 39.57 51.67 2.3 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.38 173.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.575 ' CD1' ' O ' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 78.68 111.3 0.07 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.677 -171.742 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.566 ' CD2' ' HB3' ' A' ' 12' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 116.857 -1.544 . . . . 0.0 109.754 172.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.567 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 3.2 p . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.568 HG12 ' CZ2' ' A' ' 6' ' ' TRP . 57.9 t -73.84 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 171.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.638 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -133.52 -39.87 0.89 Allowed 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.201 -1.036 . . . . 0.0 108.201 165.573 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.672 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 51.36 -175.11 0.02 OUTLIER 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.849 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.589 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 37.15 42.23 0.26 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 -170.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.672 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -156.45 -149.06 0.24 Allowed 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.103 -165.709 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.8 tp10 -50.81 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -170.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.437 ' N ' ' HG3' ' A' ' 7' ' ' GLU . . . -100.33 81.87 2.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.589 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . -41.12 147.6 0.13 Allowed 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -168.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.496 ' CD2' HG13 ' A' ' 2' ' ' VAL . 1.9 m-85 -119.32 -86.2 0.65 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.238 -167.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.415 ' HB3' HD21 ' A' ' 12' ' ' LEU . 9.8 t0 -111.27 -17.01 13.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.868 -167.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.585 ' CG ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -98.13 -38.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 172.295 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.516 ' HA ' ' CB ' ' A' ' 9' ' ' ALA . 2.0 p-10 37.68 29.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.706 170.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 23.8 mt -57.89 -27.73 63.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 172.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.5 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 5.3 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 116.879 -1.534 . . . . 0.0 109.853 175.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.507 ' CB ' HD21 ' A' ' 12' ' ' LEU . 2.4 p . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.564 ' CG1' ' CH2' ' A' ' 6' ' ' TRP . 1.5 t -93.22 -79.43 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 118.632 -0.699 . . . . 0.0 110.176 -166.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.596 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 2.5 tp60 -145.59 -35.51 0.3 Allowed 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 167.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.588 ' O ' ' CD ' ' A' ' 5' ' ' ARG . . . 65.09 179.35 0.19 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 116.01 -1.948 . . . . 0.0 108.62 -172.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.588 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 31.72 40.13 0.01 OUTLIER 'General case' 0 C--N 1.35 0.626 0 O-C-N 120.238 -1.539 . . . . 0.0 108.717 178.716 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.596 ' CE3' ' CB ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -142.68 -153.3 0.46 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 118.592 -0.718 . . . . 0.0 110.751 -166.107 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.582 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 1.4 pp20? -33.99 -31.3 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -172.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -168.0 -76.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.357 169.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.514 ' HB2' ' CB ' ' A' ' 13' ' ' ASP . . . 159.94 142.74 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.225 164.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.431 ' HB3' HG21 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -126.54 -95.84 0.44 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.08 -164.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.66 14.77 23.78 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.174 -178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.544 HD13 ' N ' ' A' ' 2' ' ' VAL . 54.4 mt -130.01 -62.52 0.94 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -172.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.54 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 60.7 t0 39.55 56.52 2.27 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.324 171.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.467 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 9.4 mt -97.2 41.96 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.706 -173.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.467 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 1.6 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 116.919 -1.515 . . . . 0.0 109.893 175.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.638 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 49.2 p . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.684 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 56.2 t -83.86 -92.94 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.016 168.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.602 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -146.22 -45.1 0.2 Allowed 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 165.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.658 ' CA ' ' CD1' ' A' ' 6' ' ' TRP . . . 55.15 -171.24 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.253 -173.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.59 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.69 35.66 0.02 OUTLIER 'General case' 0 C--N 1.35 0.627 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -174.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.684 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.2 OUTLIER -147.82 -148.34 0.25 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.696 -167.467 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.427 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 11.2 mt-10 -36.61 -29.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -170.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.453 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -169.44 -68.61 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.905 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.508 ' HB1' ' CG ' ' A' ' 13' ' ' ASP . . . 159.61 120.17 0.0 OUTLIER 'General case' 0 C--O 1.235 0.307 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.653 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.532 ' CD1' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -131.44 -71.78 0.56 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.227 -0.589 . . . . 0.0 111.13 -161.468 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.618 ' HB2' ' CG2' ' A' ' 2' ' ' VAL . 0.5 OUTLIER -110.74 20.68 17.36 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.924 -0.485 . . . . 0.0 109.706 -169.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.638 ' CD2' ' HA ' ' A' ' 1' ' ' SER . 0.0 OUTLIER -172.51 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.473 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.508 ' CG ' ' HB1' ' A' ' 9' ' ' ALA . 11.8 t0 58.3 51.55 8.27 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.432 167.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.8 mt -103.53 160.03 15.09 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 116.907 -1.52 . . . . 0.0 109.84 -176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.436 ' HA ' HD23 ' A' ' 12' ' ' LEU . 61.7 p . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.746 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 55.0 t 37.91 -100.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 118.513 -0.756 . . . . 0.0 109.406 171.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.644 ' HB3' ' CG ' ' A' ' 6' ' ' TRP . 3.4 tp60 -157.3 -61.34 0.09 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 171.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.499 ' CB ' ' HG ' ' A' ' 12' ' ' LEU . . . 76.99 -15.38 0.74 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.975 161.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.614 ' N ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -98.94 40.07 1.23 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 162.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.746 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -141.85 -145.25 0.17 Allowed 'General case' 0 C--N 1.349 0.581 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.162 -153.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.4 tm-20 -35.72 -31.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.928 -0.483 . . . . 0.0 110.077 -165.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.436 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -163.63 -75.86 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.34 170.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.514 ' CB ' ' HB2' ' A' ' 13' ' ' ASP . . . 175.63 133.77 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.404 163.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.731 ' CD2' ' CG2' ' A' ' 2' ' ' VAL . 88.4 t80 -112.53 -92.67 0.47 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.561 -164.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.569 ' HB3' ' CD2' ' A' ' 10' ' ' PHE . 6.5 p-10 -101.4 -14.72 17.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -169.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HG ' ' CB ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -104.68 -75.1 0.63 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.514 ' HB2' ' CB ' ' A' ' 9' ' ' ALA . 10.0 t0 55.52 58.43 4.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 171.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.84 45.56 1.15 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -172.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 1.2 p90 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 116.988 -1.482 . . . . 0.0 109.87 173.948 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.505 ' O ' ' CD1' ' A' ' 12' ' ' LEU . 1.5 m . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.765 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 76.4 t 38.63 -110.13 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.64 164.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -166.83 -31.41 0.03 OUTLIER 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 169.219 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.69 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.95 174.43 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.027 173.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 42.25 47.97 4.2 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -165.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -162.16 -148.46 0.14 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.022 -164.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.9 tp10 -36.69 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -168.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.438 ' O ' ' CB ' ' A' ' 9' ' ' ALA . . . -105.57 -93.67 0.36 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.333 166.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.5 ' CB ' ' HB2' ' A' ' 13' ' ' ASP . . . 164.97 160.99 0.02 OUTLIER 'General case' 0 C--N 1.34 0.188 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 161.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.64 ' CD2' ' CG2' ' A' ' 2' ' ' VAL . 8.8 m-85 -130.4 -84.69 0.53 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.272 -176.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.623 ' C ' ' CD2' ' A' ' 12' ' ' LEU . 0.5 OUTLIER -135.93 28.61 3.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.23 -167.26 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.623 ' CD2' ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -160.42 30.98 0.16 Allowed 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 176.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.559 ' HA ' ' N ' ' A' ' 5' ' ' ARG . 52.6 t0 -90.38 25.41 2.25 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.424 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.536 ' CD2' ' C ' ' A' ' 13' ' ' ASP . 0.1 OUTLIER -151.86 -69.62 0.17 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.741 -173.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 116.893 -1.527 . . . . 0.0 109.834 -178.236 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.418 ' HA ' HD22 ' A' ' 12' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 119.41 -0.328 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.701 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 44.4 t -69.04 -99.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 117.671 -1.157 . . . . 0.0 108.719 167.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.614 ' CA ' HD13 ' A' ' 12' ' ' LEU . 2.9 tp-100 -170.74 -36.21 0.02 OUTLIER 'General case' 0 C--O 1.235 0.312 0 CA-C-O 118.58 -0.724 . . . . 0.0 109.139 166.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.539 ' HB1' ' N ' ' A' ' 13' ' ' ASP . . . 81.1 -62.88 0.19 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.073 168.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.461 ' H ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -78.7 63.92 3.58 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 116.342 -1.79 . . . . 0.0 106.853 174.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.701 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.0 OUTLIER -164.87 -148.51 0.11 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.482 -155.261 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.0 mm-40 -44.33 -96.8 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.501 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -125.45 93.14 3.77 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.22 -0.895 . . . . 0.0 108.78 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.499 ' CB ' ' HA ' ' A' ' 13' ' ' ASP . . . -36.9 148.23 0.03 OUTLIER 'General case' 0 C--N 1.339 0.132 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -162.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.501 ' CD2' ' O ' ' A' ' 8' ' ' ALA . 6.8 m-85 -129.03 -83.92 0.57 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.493 -167.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -105.21 -40.91 5.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.862 -167.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.757 ' CD2' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -72.88 -54.08 9.7 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 167.813 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.539 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 66.41 5.8 3.96 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.919 170.305 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' C ' ' CD1' ' A' ' 14' ' ' LEU . 0.2 OUTLIER 168.66 49.05 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 169.466 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' A' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.122 0 CA-C-O 116.831 -1.557 . . . . 0.0 109.825 179.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.44 ' HA ' HD23 ' A' ' 12' ' ' LEU . 58.6 m . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.42 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.756 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 90.7 t -68.6 -100.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 117.535 -1.221 . . . . 0.0 108.881 167.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.642 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -159.55 -35.66 0.06 Allowed 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 165.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.763 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.29 173.56 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.949 176.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.591 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 45.04 49.81 9.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 -165.093 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.763 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -165.83 -148.71 0.1 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.091 -163.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -35.67 -71.07 0.08 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.314 -0.374 . . . . 0.0 110.046 -167.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.446 ' O ' ' CB ' ' A' ' 9' ' ' ALA . . . -111.05 -93.26 0.45 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.087 164.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.452 ' CB ' ' OD2' ' A' ' 13' ' ' ASP . . . 163.97 151.57 0.02 OUTLIER 'General case' 0 C--N 1.339 0.115 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.858 160.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.634 ' CD1' ' CG1' ' A' ' 2' ' ' VAL . 14.0 m-85 -109.56 -60.27 1.8 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.201 -170.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -164.59 -40.96 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.61 -167.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.61 HD11 ' CA ' ' A' ' 3' ' ' GLN . 0.2 OUTLIER -85.61 25.53 1.05 Allowed 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.562 ' HA ' ' N ' ' A' ' 5' ' ' ARG . 22.9 t0 -55.97 -14.14 2.34 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.78 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -176.18 39.37 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 174.976 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.489 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.94 -1.505 . . . . 0.0 109.809 -174.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.644 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 46.2 m . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.614 ' CG2' ' HB3' ' A' ' 10' ' ' PHE . 1.5 t -129.82 -77.96 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.415 170.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 1.1 tp-100 -151.86 -50.64 0.11 Allowed 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 164.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.584 ' O ' ' CD ' ' A' ' 5' ' ' ARG . . . 70.9 -179.86 0.23 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 48.83 28.93 2.08 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -174.037 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.64 ' CE3' ' CB ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -155.43 -149.84 0.28 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.356 -160.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.506 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.6 mm-40 -38.59 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 43.87 -97.8 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -166.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.549 ' CB ' ' CG ' ' A' ' 13' ' ' ASP . . . -177.05 140.46 0.3 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.358 165.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.614 ' HB3' ' CG2' ' A' ' 2' ' ' VAL . 3.4 m-85 -104.35 -91.83 0.37 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.397 -164.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.469 ' C ' HD21 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -104.81 -12.62 16.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -170.408 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.69 ' CD2' ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -111.0 -66.73 1.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.576 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.549 ' CG ' ' CB ' ' A' ' 9' ' ' ALA . 46.9 t0 50.33 19.51 0.54 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.773 178.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' LEU . 31.6 mt 38.83 32.13 0.05 Allowed 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.122 0.263 . . . . 0.0 110.768 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.501 ' C ' ' CD1' ' A' ' 15' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.059 0 CA-C-O 116.941 -1.504 . . . . 0.0 109.788 -173.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.638 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 2.2 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.754 ' CG1' ' CZ2' ' A' ' 6' ' ' TRP . 88.1 t 31.86 -101.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 117.261 -1.352 . . . . 0.0 108.945 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -160.43 -41.08 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 164.688 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.841 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 49.51 171.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.797 177.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 52.95 47.36 24.82 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -165.537 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.841 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -174.03 -151.76 0.05 OUTLIER 'General case' 0 C--N 1.348 0.51 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.853 -160.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.604 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 2.1 mt-10 -41.47 97.02 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -170.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.424 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 51.42 -94.25 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -165.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.424 ' N ' ' O ' ' A' ' 7' ' ' GLU . . . 174.19 134.58 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 167.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.658 ' CD1' ' CG1' ' A' ' 2' ' ' VAL . 0.5 OUTLIER -83.56 -75.65 0.32 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.779 -167.428 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' ' C ' ' A' ' 12' ' ' LEU . 32.6 t70 -141.83 -77.71 0.27 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.793 -173.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.638 ' CD2' ' HA ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -40.05 -41.09 1.17 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 174.077 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.514 ' HA ' ' CB ' ' A' ' 4' ' ' ALA . 6.5 t70 33.84 57.24 0.58 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.484 177.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' ' CD1' ' A' ' 14' ' ' LEU . 4.1 pp -171.19 31.2 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.132 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.553 ' CG ' ' C ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.195 0 CA-C-O 116.543 -1.694 . . . . 0.0 109.593 -170.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.889 ' O ' HD11 ' A' ' 12' ' ' LEU . 57.8 m . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.997 HG21 ' CD2' ' A' ' 10' ' ' PHE . 61.1 t 63.55 -103.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-O 116.341 -1.79 . . . . 0.0 107.739 -162.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.918 ' CB ' ' CD1' ' A' ' 6' ' ' TRP . 1.3 mt-30 -164.17 -36.26 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.975 -0.453 . . . . 0.0 110.088 162.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.984 ' HB1' ' N ' ' A' ' 13' ' ' ASP . . . 53.14 -176.35 0.03 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.578 -175.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.66 ' H ' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 48.16 27.17 1.2 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -170.865 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.918 ' CD1' ' CB ' ' A' ' 3' ' ' GLN . 0.0 OUTLIER -162.29 -154.32 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.7 -162.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CD2' ' A' ' 6' ' ' TRP . 44.4 tt0 -32.51 96.01 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.115 -0.366 . . . . 0.0 110.842 -164.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 57.81 -92.95 0.04 OUTLIER 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 -170.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.833 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 170.39 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.997 ' CD2' HG21 ' A' ' 2' ' ' VAL . 1.6 t80 -65.71 -53.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 t70 175.9 -30.49 0.0 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.889 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -82.26 12.43 4.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 117.569 -1.205 . . . . 0.0 110.177 178.542 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.984 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 20.7 t0 . . . . . 0 N--CA 1.453 -0.317 0 O-C-N 121.37 -0.831 . . . . 0.0 109.849 166.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.989 ' O ' HD11 ' A' ' 12' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 118.801 -0.619 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 3' ' ' GLN . 62.3 t 39.32 -107.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 117.616 -1.183 . . . . 0.0 109.152 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.766 ' H ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -159.23 -33.57 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 166.445 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.818 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 60.83 -179.95 0.1 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.229 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.593 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.77 43.47 0.1 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 118.943 -1.103 . . . . 0.0 108.029 -175.745 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -154.09 -151.59 0.37 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.543 -166.046 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.1 mt-10 -38.3 -81.18 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -172.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.497 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -131.22 87.9 2.53 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.755 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.02 156.13 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.93 -165.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.735 ' HD2' HG11 ' A' ' 2' ' ' VAL . 29.9 m-85 -142.41 -87.88 0.15 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.649 -167.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.958 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.4 m-20 -85.49 7.32 23.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.031 -167.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.989 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -142.97 -48.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -176.838 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.755 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 25.5 t70 . . . . . 0 N--CA 1.453 -0.32 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.38 173.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' SER . . . . . 1.067 ' HA ' HD21 ' A' ' 12' ' ' LEU . 3.2 p . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.717 HG11 ' CD2' ' A' ' 10' ' ' PHE . 57.9 t -73.84 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 171.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.782 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -133.52 -39.87 0.89 Allowed 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.201 -1.036 . . . . 0.0 108.201 165.573 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.664 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 51.36 -175.11 0.02 OUTLIER 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.849 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.589 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 37.15 42.23 0.26 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 -170.911 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.664 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -156.45 -149.06 0.24 Allowed 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.103 -165.709 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.8 tp10 -50.81 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -170.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 7' ' ' GLU . . . -100.33 81.87 2.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.12 147.6 0.13 Allowed 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -168.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.717 ' CD2' HG11 ' A' ' 2' ' ' VAL . 1.9 m-85 -119.32 -86.2 0.65 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.238 -167.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.534 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 t0 -111.27 -17.01 13.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.868 -167.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.067 HD21 ' HA ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -98.13 -38.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 172.295 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.916 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 2.0 p-10 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.706 170.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.97 ' CB ' HD21 ' A' ' 12' ' ' LEU . 2.4 p . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.595 HG21 ' CB ' ' A' ' 10' ' ' PHE . 1.5 t -93.22 -79.43 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 118.632 -0.699 . . . . 0.0 110.176 -166.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.596 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 2.5 tp60 -145.59 -35.51 0.3 Allowed 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 167.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 1.045 ' HB2' ' CB ' ' A' ' 12' ' ' LEU . . . 65.09 179.35 0.19 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 116.01 -1.948 . . . . 0.0 108.62 -172.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.588 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 31.72 40.13 0.01 OUTLIER 'General case' 0 C--N 1.35 0.626 0 O-C-N 120.238 -1.539 . . . . 0.0 108.717 178.716 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CE2' ' HG3' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -142.68 -153.3 0.46 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 118.592 -0.718 . . . . 0.0 110.751 -166.107 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.6 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 1.4 pp20? -33.99 -31.3 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -172.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.625 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -168.0 -76.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.357 169.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.817 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 159.94 142.74 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.225 164.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.595 ' CB ' HG21 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -126.54 -95.84 0.44 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.08 -164.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.613 ' O ' HD23 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -96.66 14.77 23.78 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.174 -178.993 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.045 ' CB ' ' HB2' ' A' ' 4' ' ' ALA . 54.4 mt -130.01 -62.52 0.94 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -172.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.817 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 60.7 t0 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.324 171.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.634 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 49.2 p . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.836 HG23 ' HB2' ' A' ' 11' ' ' ASP . 56.2 t -83.86 -92.94 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.016 168.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.602 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -146.22 -45.1 0.2 Allowed 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 165.254 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.694 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 55.15 -171.24 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.253 -173.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.59 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.69 35.66 0.02 OUTLIER 'General case' 0 C--N 1.35 0.627 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -174.052 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.731 ' CZ2' HG11 ' A' ' 2' ' ' VAL . 0.2 OUTLIER -147.82 -148.34 0.25 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.696 -167.467 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.427 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 11.2 mt-10 -36.61 -29.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -170.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.644 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -169.44 -68.61 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.905 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.828 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 159.61 120.17 0.0 OUTLIER 'General case' 0 C--O 1.235 0.307 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.653 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CD1' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -131.44 -71.78 0.56 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.227 -0.589 . . . . 0.0 111.13 -161.468 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.869 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -110.74 20.68 17.36 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.924 -0.485 . . . . 0.0 109.706 -169.849 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.869 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -172.51 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.473 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.828 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 11.8 t0 . . . . . 0 N--CA 1.455 -0.225 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.432 167.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.425 ' O ' HD11 ' A' ' 12' ' ' LEU . 61.7 p . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 1.034 HG21 ' CD2' ' A' ' 10' ' ' PHE . 55.0 t 37.91 -100.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 118.513 -0.756 . . . . 0.0 109.406 171.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 2' ' ' VAL . 3.1 tp-100 -157.3 -61.34 0.09 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 171.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 1.004 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 76.99 -15.38 0.74 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.975 161.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.842 ' H ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -98.94 40.07 1.23 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 162.022 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.746 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -141.85 -145.25 0.17 Allowed 'General case' 0 C--N 1.349 0.581 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.162 -153.761 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.512 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.4 tm-20 -35.72 -31.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.928 -0.483 . . . . 0.0 110.077 -165.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.436 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -163.63 -75.86 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.34 170.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.843 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 175.63 133.77 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.404 163.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 1.034 ' CD2' HG21 ' A' ' 2' ' ' VAL . 88.4 t80 -112.53 -92.67 0.47 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.561 -164.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.555 ' HB3' ' CD2' ' A' ' 10' ' ' PHE . 6.5 p-10 -101.4 -14.72 17.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -169.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.004 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -104.68 -75.1 0.63 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.843 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 10.0 t0 . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 171.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' SER . . . . . 1.019 ' O ' HD11 ' A' ' 12' ' ' LEU . 1.5 m . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 1.169 HG21 ' CD2' ' A' ' 10' ' ' PHE . 76.4 t 38.63 -110.13 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.64 164.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.992 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -166.83 -31.41 0.03 OUTLIER 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 169.219 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.685 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.95 174.43 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.027 173.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 42.25 47.97 4.2 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -165.095 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -162.16 -148.46 0.14 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.022 -164.735 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.9 tp10 -36.69 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -168.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -105.57 -93.67 0.36 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.333 166.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.974 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . 164.97 160.99 0.02 OUTLIER 'General case' 0 C--N 1.34 0.188 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 161.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 1.169 ' CD2' HG21 ' A' ' 2' ' ' VAL . 8.8 m-85 -130.4 -84.69 0.53 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.272 -176.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 1.026 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -135.93 28.61 3.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.23 -167.26 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.026 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -160.42 30.98 0.16 Allowed 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 176.884 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.974 ' HB2' ' HB1' ' A' ' 9' ' ' ALA . 52.6 t0 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.424 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 119.41 -0.328 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.785 HG13 ' CH2' ' A' ' 6' ' ' TRP . 44.4 t -69.04 -99.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 117.671 -1.157 . . . . 0.0 108.719 167.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.73 ' O ' HD12 ' A' ' 12' ' ' LEU . 2.9 tp-100 -170.74 -36.21 0.02 OUTLIER 'General case' 0 C--O 1.235 0.312 0 CA-C-O 118.58 -0.724 . . . . 0.0 109.139 166.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.668 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 81.1 -62.88 0.19 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.073 168.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.493 ' H ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -78.7 63.92 3.58 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 116.342 -1.79 . . . . 0.0 106.853 174.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.785 ' CH2' HG13 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -164.87 -148.51 0.11 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.482 -155.261 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.0 mm-40 -44.33 -96.8 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.501 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -125.45 93.14 3.77 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.22 -0.895 . . . . 0.0 108.78 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 1.037 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -36.9 148.23 0.03 OUTLIER 'General case' 0 C--N 1.339 0.132 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -162.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.693 ' CB ' HG21 ' A' ' 2' ' ' VAL . 6.8 m-85 -129.03 -83.92 0.57 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.493 -167.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -105.21 -40.91 5.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.862 -167.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 1.034 HD23 ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -72.88 -54.08 9.7 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 167.813 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 1.037 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.919 170.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 1.062 HG21 ' CD2' ' A' ' 10' ' ' PHE . 90.7 t -68.6 -100.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 117.535 -1.221 . . . . 0.0 108.881 167.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.661 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.55 -35.66 0.06 Allowed 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 165.423 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.759 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.29 173.56 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.949 176.032 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.591 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 45.04 49.81 9.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 -165.093 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.759 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -165.83 -148.71 0.1 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.091 -163.301 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -35.67 -71.07 0.08 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.314 -0.374 . . . . 0.0 110.046 -167.585 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.633 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -111.05 -93.26 0.45 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.087 164.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 163.97 151.57 0.02 OUTLIER 'General case' 0 C--N 1.339 0.115 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.858 160.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 1.062 ' CD2' HG21 ' A' ' 2' ' ' VAL . 14.0 m-85 -109.56 -60.27 1.8 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.201 -170.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -164.59 -40.96 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.61 -167.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 3' ' ' GLN . 0.2 OUTLIER -85.61 25.53 1.05 Allowed 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.729 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.749 ' CA ' ' HB1' ' A' ' 4' ' ' ALA . 22.9 t0 . . . . . 0 C--N 1.342 0.243 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.78 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.708 ' HA ' HD21 ' A' ' 12' ' ' LEU . 46.2 m . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 0.808 HG21 ' HB3' ' A' ' 10' ' ' PHE . 1.5 t -129.82 -77.96 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.415 170.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.841 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.1 tp-100 -151.86 -50.64 0.11 Allowed 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 164.047 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.704 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 70.9 -179.86 0.23 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 48.83 28.93 2.08 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -174.037 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.782 ' CH2' HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -155.43 -149.84 0.28 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.356 -160.663 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.506 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.6 mm-40 -38.59 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 43.87 -97.8 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -166.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.631 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . -177.05 140.46 0.3 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.358 165.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.808 ' HB3' HG21 ' A' ' 2' ' ' VAL . 3.4 m-85 -104.35 -91.83 0.37 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.397 -164.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.873 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -104.81 -12.62 16.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -170.408 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.873 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -111.0 -66.73 1.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.576 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.704 ' H ' ' HB2' ' A' ' 4' ' ' ALA . 46.9 t0 . . . . . 0 N--CA 1.453 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.773 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' SER . . . . . 0.628 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 2.2 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' VAL . . . . . 1.178 HG21 ' CD2' ' A' ' 10' ' ' PHE . 88.1 t 31.86 -101.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 117.261 -1.352 . . . . 0.0 108.945 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -160.43 -41.08 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 164.688 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.993 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 49.51 171.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.797 177.074 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 52.95 47.36 24.82 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -165.537 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.83 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -174.03 -151.76 0.05 OUTLIER 'General case' 0 C--N 1.348 0.51 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.853 -160.396 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.604 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 2.1 mt-10 -41.47 97.02 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -170.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 51.42 -94.25 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -165.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.495 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 174.19 134.58 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 167.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 1.178 ' CD2' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -83.56 -75.65 0.32 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.779 -167.428 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' ' C ' ' A' ' 12' ' ' LEU . 32.6 t70 -141.83 -77.71 0.27 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.793 -173.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.794 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -40.05 -41.09 1.17 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 174.077 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.993 ' HA ' ' HB1' ' A' ' 4' ' ' ALA . 6.5 t70 . . . . . 0 N--CA 1.452 -0.365 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.484 177.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.889 ' O ' HD11 ' A' ' 12' ' ' LEU . 57.8 m . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.997 HG21 ' CD2' ' A' ' 10' ' ' PHE . 61.1 t 63.55 -103.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-O 116.341 -1.79 . . . . 0.0 107.739 -162.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.918 ' CB ' ' CD1' ' A' ' 6' ' ' TRP . 1.3 mt-30 -164.17 -36.26 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.975 -0.453 . . . . 0.0 110.088 162.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.984 ' HB1' ' N ' ' A' ' 13' ' ' ASP . . . 53.14 -176.35 0.03 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.578 -175.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.66 ' H ' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 48.16 27.17 1.2 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -170.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.918 ' CD1' ' CB ' ' A' ' 3' ' ' GLN . 0.0 OUTLIER -162.29 -154.32 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.7 -162.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CD2' ' A' ' 6' ' ' TRP . 44.4 tt0 -32.51 96.01 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.115 -0.366 . . . . 0.0 110.842 -164.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 57.81 -92.95 0.04 OUTLIER 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 -170.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.833 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 170.39 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.997 ' CD2' HG21 ' A' ' 2' ' ' VAL . 1.6 t80 -65.71 -53.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 t70 175.9 -30.49 0.0 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.889 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -82.26 12.43 4.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 117.569 -1.205 . . . . 0.0 110.177 178.542 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.984 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 20.7 t0 -63.89 -5.51 4.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.37 -0.831 . . . . 0.0 109.849 166.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.524 ' N ' HD23 ' A' ' 14' ' ' LEU . 5.1 mt 59.8 78.82 0.25 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.781 177.008 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.989 ' O ' HD11 ' A' ' 12' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 118.801 -0.619 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 3' ' ' GLN . 62.3 t 39.32 -107.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 117.616 -1.183 . . . . 0.0 109.152 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.766 ' H ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -159.23 -33.57 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 166.445 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.818 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 60.83 -179.95 0.1 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.229 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.593 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.77 43.47 0.1 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 118.943 -1.103 . . . . 0.0 108.029 -175.745 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -154.09 -151.59 0.37 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.543 -166.046 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.1 mt-10 -38.3 -81.18 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -172.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.497 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -131.22 87.9 2.53 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.755 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.02 156.13 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.93 -165.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.735 ' HD2' HG11 ' A' ' 2' ' ' VAL . 29.9 m-85 -142.41 -87.88 0.15 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.649 -167.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.958 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.4 m-20 -85.49 7.32 23.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.031 -167.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.989 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -142.97 -48.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -176.838 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.942 ' O ' HD12 ' A' ' 14' ' ' LEU . 25.5 t70 39.57 51.67 2.3 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.38 173.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.942 HD12 ' O ' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 78.68 111.3 0.07 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.677 -171.742 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.567 ' CD2' ' HB3' ' A' ' 12' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 116.857 -1.544 . . . . 0.0 109.754 172.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . 1.067 ' HA ' HD21 ' A' ' 12' ' ' LEU . 3.2 p . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.717 HG11 ' CD2' ' A' ' 10' ' ' PHE . 57.9 t -73.84 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 171.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.782 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -133.52 -39.87 0.89 Allowed 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.201 -1.036 . . . . 0.0 108.201 165.573 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.664 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 51.36 -175.11 0.02 OUTLIER 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.849 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.589 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 37.15 42.23 0.26 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 -170.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.664 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -156.45 -149.06 0.24 Allowed 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.103 -165.709 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.8 tp10 -50.81 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -170.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 7' ' ' GLU . . . -100.33 81.87 2.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.12 147.6 0.13 Allowed 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -168.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.717 ' CD2' HG11 ' A' ' 2' ' ' VAL . 1.9 m-85 -119.32 -86.2 0.65 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.238 -167.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.534 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 t0 -111.27 -17.01 13.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.868 -167.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.067 HD21 ' HA ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -98.13 -38.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 172.295 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.916 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 2.0 p-10 37.68 29.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.706 170.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 23.8 mt -57.89 -27.73 63.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 172.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.5 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 5.3 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 116.879 -1.534 . . . . 0.0 109.853 175.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.97 ' CB ' HD21 ' A' ' 12' ' ' LEU . 2.4 p . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.595 HG21 ' CB ' ' A' ' 10' ' ' PHE . 1.5 t -93.22 -79.43 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 118.632 -0.699 . . . . 0.0 110.176 -166.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.596 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 2.5 tp60 -145.59 -35.51 0.3 Allowed 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 167.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 1.045 ' HB2' ' CB ' ' A' ' 12' ' ' LEU . . . 65.09 179.35 0.19 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 116.01 -1.948 . . . . 0.0 108.62 -172.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.588 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 31.72 40.13 0.01 OUTLIER 'General case' 0 C--N 1.35 0.626 0 O-C-N 120.238 -1.539 . . . . 0.0 108.717 178.716 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CE2' ' HG3' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -142.68 -153.3 0.46 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 118.592 -0.718 . . . . 0.0 110.751 -166.107 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.6 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 1.4 pp20? -33.99 -31.3 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -172.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.625 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -168.0 -76.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.357 169.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.817 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 159.94 142.74 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.225 164.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.595 ' CB ' HG21 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -126.54 -95.84 0.44 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.08 -164.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.613 ' O ' HD23 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -96.66 14.77 23.78 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.174 -178.993 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.045 ' CB ' ' HB2' ' A' ' 4' ' ' ALA . 54.4 mt -130.01 -62.52 0.94 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -172.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.817 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 60.7 t0 39.55 56.52 2.27 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.324 171.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.638 ' H ' ' HB1' ' A' ' 4' ' ' ALA . 9.4 mt -97.2 41.96 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.706 -173.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.467 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 1.6 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 116.919 -1.515 . . . . 0.0 109.893 175.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.634 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 49.2 p . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.836 HG23 ' HB2' ' A' ' 11' ' ' ASP . 56.2 t -83.86 -92.94 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.016 168.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.602 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -146.22 -45.1 0.2 Allowed 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 165.254 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.694 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 55.15 -171.24 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.253 -173.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.59 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.69 35.66 0.02 OUTLIER 'General case' 0 C--N 1.35 0.627 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -174.052 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.731 ' CZ2' HG11 ' A' ' 2' ' ' VAL . 0.2 OUTLIER -147.82 -148.34 0.25 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.696 -167.467 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.427 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 11.2 mt-10 -36.61 -29.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -170.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.644 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -169.44 -68.61 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.905 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.828 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 159.61 120.17 0.0 OUTLIER 'General case' 0 C--O 1.235 0.307 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.653 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CD1' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -131.44 -71.78 0.56 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.227 -0.589 . . . . 0.0 111.13 -161.468 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.869 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -110.74 20.68 17.36 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.924 -0.485 . . . . 0.0 109.706 -169.849 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.869 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -172.51 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.473 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.828 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 11.8 t0 58.3 51.55 8.27 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.432 167.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.8 mt -103.53 160.03 15.09 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 116.907 -1.52 . . . . 0.0 109.84 -176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.425 ' O ' HD11 ' A' ' 12' ' ' LEU . 61.7 p . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 1.034 HG21 ' CD2' ' A' ' 10' ' ' PHE . 55.0 t 37.91 -100.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 118.513 -0.756 . . . . 0.0 109.406 171.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 2' ' ' VAL . 3.1 tp-100 -157.3 -61.34 0.09 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 171.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 1.004 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 76.99 -15.38 0.74 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.975 161.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.842 ' H ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -98.94 40.07 1.23 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 162.022 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.746 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -141.85 -145.25 0.17 Allowed 'General case' 0 C--N 1.349 0.581 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.162 -153.761 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.4 tm-20 -35.72 -31.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.928 -0.483 . . . . 0.0 110.077 -165.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.436 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -163.63 -75.86 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.34 170.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.843 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 175.63 133.77 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.404 163.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 1.034 ' CD2' HG21 ' A' ' 2' ' ' VAL . 88.4 t80 -112.53 -92.67 0.47 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.561 -164.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.555 ' HB3' ' CD2' ' A' ' 10' ' ' PHE . 6.5 p-10 -101.4 -14.72 17.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -169.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.004 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -104.68 -75.1 0.63 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.843 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 10.0 t0 55.52 58.43 4.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 171.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.415 HD12 ' H ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -93.84 45.56 1.15 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -172.795 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 1.2 p90 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 116.988 -1.482 . . . . 0.0 109.87 173.948 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . 1.019 ' O ' HD11 ' A' ' 12' ' ' LEU . 1.5 m . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 1.169 HG21 ' CD2' ' A' ' 10' ' ' PHE . 76.4 t 38.63 -110.13 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.64 164.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.992 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -166.83 -31.41 0.03 OUTLIER 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 169.219 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.685 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.95 174.43 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.027 173.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 42.25 47.97 4.2 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -165.095 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -162.16 -148.46 0.14 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.022 -164.735 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.9 tp10 -36.69 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -168.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -105.57 -93.67 0.36 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.333 166.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.974 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . 164.97 160.99 0.02 OUTLIER 'General case' 0 C--N 1.34 0.188 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 161.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 1.169 ' CD2' HG21 ' A' ' 2' ' ' VAL . 8.8 m-85 -130.4 -84.69 0.53 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.272 -176.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 1.026 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -135.93 28.61 3.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.23 -167.26 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.026 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -160.42 30.98 0.16 Allowed 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 176.884 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 1.019 ' C ' HD23 ' A' ' 14' ' ' LEU . 52.6 t0 -90.38 25.41 2.25 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.424 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 1.019 HD23 ' C ' ' A' ' 13' ' ' ASP . 0.1 OUTLIER -151.86 -69.62 0.17 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.741 -173.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 116.893 -1.527 . . . . 0.0 109.834 -178.236 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 119.41 -0.328 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.785 HG13 ' CH2' ' A' ' 6' ' ' TRP . 44.4 t -69.04 -99.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 117.671 -1.157 . . . . 0.0 108.719 167.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.73 ' O ' HD12 ' A' ' 12' ' ' LEU . 2.9 tp-100 -170.74 -36.21 0.02 OUTLIER 'General case' 0 C--O 1.235 0.312 0 CA-C-O 118.58 -0.724 . . . . 0.0 109.139 166.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.668 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 81.1 -62.88 0.19 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.073 168.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.493 ' H ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -78.7 63.92 3.58 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 116.342 -1.79 . . . . 0.0 106.853 174.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.785 ' CH2' HG13 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -164.87 -148.51 0.11 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.482 -155.261 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.0 mm-40 -44.33 -96.8 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.501 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -125.45 93.14 3.77 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.22 -0.895 . . . . 0.0 108.78 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 1.037 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -36.9 148.23 0.03 OUTLIER 'General case' 0 C--N 1.339 0.132 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -162.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.693 ' CB ' HG21 ' A' ' 2' ' ' VAL . 6.8 m-85 -129.03 -83.92 0.57 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.493 -167.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -105.21 -40.91 5.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.862 -167.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 1.034 HD23 ' N ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -72.88 -54.08 9.7 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 167.813 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 1.037 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER 66.41 5.8 3.96 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.919 170.305 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' C ' ' CD1' ' A' ' 14' ' ' LEU . 0.2 OUTLIER 168.66 49.05 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 169.466 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.618 ' HD2' HD13 ' A' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.122 0 CA-C-O 116.831 -1.557 . . . . 0.0 109.825 179.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 1.062 HG21 ' CD2' ' A' ' 10' ' ' PHE . 90.7 t -68.6 -100.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 117.535 -1.221 . . . . 0.0 108.881 167.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.661 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.55 -35.66 0.06 Allowed 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 165.423 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.759 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.29 173.56 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.949 176.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.591 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 45.04 49.81 9.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 -165.093 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.759 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -165.83 -148.71 0.1 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.091 -163.301 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -35.67 -71.07 0.08 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.314 -0.374 . . . . 0.0 110.046 -167.585 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.633 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -111.05 -93.26 0.45 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.087 164.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 163.97 151.57 0.02 OUTLIER 'General case' 0 C--N 1.339 0.115 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.858 160.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 1.062 ' CD2' HG21 ' A' ' 2' ' ' VAL . 14.0 m-85 -109.56 -60.27 1.8 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.201 -170.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -164.59 -40.96 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.61 -167.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 3' ' ' GLN . 0.2 OUTLIER -85.61 25.53 1.05 Allowed 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.749 ' CA ' ' HB1' ' A' ' 4' ' ' ALA . 22.9 t0 -55.97 -14.14 2.34 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.78 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.642 HD23 ' C ' ' A' ' 13' ' ' ASP . 0.4 OUTLIER -176.18 39.37 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 174.976 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.489 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.94 -1.505 . . . . 0.0 109.809 -174.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.708 ' HA ' HD21 ' A' ' 12' ' ' LEU . 46.2 m . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.808 HG21 ' HB3' ' A' ' 10' ' ' PHE . 1.5 t -129.82 -77.96 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.415 170.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.841 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.1 tp-100 -151.86 -50.64 0.11 Allowed 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 164.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.704 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 70.9 -179.86 0.23 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.633 ' HG2' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER 48.83 28.93 2.08 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -174.037 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.782 ' CH2' HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -155.43 -149.84 0.28 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.356 -160.663 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.506 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.6 mm-40 -38.59 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 43.87 -97.8 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -166.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.631 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . -177.05 140.46 0.3 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.358 165.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.808 ' HB3' HG21 ' A' ' 2' ' ' VAL . 3.4 m-85 -104.35 -91.83 0.37 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.397 -164.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.873 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -104.81 -12.62 16.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -170.408 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.873 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -111.0 -66.73 1.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.576 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.704 ' H ' ' HB2' ' A' ' 4' ' ' ALA . 46.9 t0 50.33 19.51 0.54 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.773 178.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.633 HD11 ' HG2' ' A' ' 5' ' ' ARG . 31.6 mt 38.83 32.13 0.05 Allowed 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.122 0.263 . . . . 0.0 110.768 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.501 ' C ' ' CD1' ' A' ' 15' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.059 0 CA-C-O 116.941 -1.504 . . . . 0.0 109.788 -173.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.628 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 2.2 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 1.178 HG21 ' CD2' ' A' ' 10' ' ' PHE . 88.1 t 31.86 -101.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 117.261 -1.352 . . . . 0.0 108.945 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -160.43 -41.08 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 164.688 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.993 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 49.51 171.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.797 177.074 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' O ' ' CD ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 52.95 47.36 24.82 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -165.537 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.83 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -174.03 -151.76 0.05 OUTLIER 'General case' 0 C--N 1.348 0.51 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.853 -160.396 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.604 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 2.1 mt-10 -41.47 97.02 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -170.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 51.42 -94.25 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -165.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.495 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 174.19 134.58 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 167.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 1.178 ' CD2' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -83.56 -75.65 0.32 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.779 -167.428 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' ' C ' ' A' ' 12' ' ' LEU . 32.6 t70 -141.83 -77.71 0.27 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.793 -173.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.794 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -40.05 -41.09 1.17 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 174.077 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.993 ' HA ' ' HB1' ' A' ' 4' ' ' ALA . 6.5 t70 33.84 57.24 0.58 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.484 177.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.828 ' O ' HD12 ' A' ' 14' ' ' LEU . 4.1 pp -171.19 31.2 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.132 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.553 ' CG ' ' C ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.195 0 CA-C-O 116.543 -1.694 . . . . 0.0 109.593 -170.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.889 ' O ' HD11 ' A' ' 12' ' ' LEU . 57.8 m . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.997 HG21 ' CD2' ' A' ' 10' ' ' PHE . 61.1 t 63.55 -103.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-O 116.341 -1.79 . . . . 0.0 107.739 -162.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.918 ' CB ' ' CD1' ' A' ' 6' ' ' TRP . 1.3 mt-30 -164.17 -36.26 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.975 -0.453 . . . . 0.0 110.088 162.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.984 ' HB1' ' N ' ' A' ' 13' ' ' ASP . . . 53.14 -176.35 0.03 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.578 -175.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.66 ' H ' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 48.16 27.17 1.2 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -170.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.918 ' CD1' ' CB ' ' A' ' 3' ' ' GLN . 0.0 OUTLIER -162.29 -154.32 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.7 -162.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CD2' ' A' ' 6' ' ' TRP . 44.4 tt0 -32.51 96.01 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.115 -0.366 . . . . 0.0 110.842 -164.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 57.81 -92.95 0.04 OUTLIER 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 -170.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.833 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 170.39 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.997 ' CD2' HG21 ' A' ' 2' ' ' VAL . 1.6 t80 -65.71 -53.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 t70 175.9 -30.49 0.0 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.889 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -82.26 12.43 4.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 117.569 -1.205 . . . . 0.0 110.177 178.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.984 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 20.7 t0 . . . . . 0 N--CA 1.453 -0.317 0 O-C-N 121.37 -0.831 . . . . 0.0 109.849 166.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.989 ' O ' HD11 ' A' ' 12' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 118.801 -0.619 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 3' ' ' GLN . 62.3 t 39.32 -107.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 117.616 -1.183 . . . . 0.0 109.152 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.766 ' H ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -159.23 -33.57 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 166.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.818 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 60.83 -179.95 0.1 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.229 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.593 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.77 43.47 0.1 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 118.943 -1.103 . . . . 0.0 108.029 -175.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -154.09 -151.59 0.37 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.543 -166.046 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.1 mt-10 -38.3 -81.18 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -172.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.497 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -131.22 87.9 2.53 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.755 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.02 156.13 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.93 -165.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.735 ' HD2' HG11 ' A' ' 2' ' ' VAL . 29.9 m-85 -142.41 -87.88 0.15 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.649 -167.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.958 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.4 m-20 -85.49 7.32 23.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.031 -167.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.989 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -142.97 -48.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -176.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.755 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 25.5 t70 . . . . . 0 N--CA 1.453 -0.32 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.38 173.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 1.067 ' HA ' HD21 ' A' ' 12' ' ' LEU . 3.2 p . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.717 HG11 ' CD2' ' A' ' 10' ' ' PHE . 57.9 t -73.84 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 171.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.782 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -133.52 -39.87 0.89 Allowed 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.201 -1.036 . . . . 0.0 108.201 165.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.664 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 51.36 -175.11 0.02 OUTLIER 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.849 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.589 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 37.15 42.23 0.26 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 -170.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.664 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -156.45 -149.06 0.24 Allowed 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.103 -165.709 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.8 tp10 -50.81 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -170.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 7' ' ' GLU . . . -100.33 81.87 2.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.12 147.6 0.13 Allowed 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -168.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.717 ' CD2' HG11 ' A' ' 2' ' ' VAL . 1.9 m-85 -119.32 -86.2 0.65 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.238 -167.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.534 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 t0 -111.27 -17.01 13.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.868 -167.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.067 HD21 ' HA ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -98.13 -38.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 172.295 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.916 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 2.0 p-10 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.706 170.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.97 ' CB ' HD21 ' A' ' 12' ' ' LEU . 2.4 p . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.595 HG21 ' CB ' ' A' ' 10' ' ' PHE . 1.5 t -93.22 -79.43 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 118.632 -0.699 . . . . 0.0 110.176 -166.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.596 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 2.5 tp60 -145.59 -35.51 0.3 Allowed 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 167.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 1.045 ' HB2' ' CB ' ' A' ' 12' ' ' LEU . . . 65.09 179.35 0.19 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 116.01 -1.948 . . . . 0.0 108.62 -172.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.588 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 31.72 40.13 0.01 OUTLIER 'General case' 0 C--N 1.35 0.626 0 O-C-N 120.238 -1.539 . . . . 0.0 108.717 178.716 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CE2' ' HG3' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -142.68 -153.3 0.46 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 118.592 -0.718 . . . . 0.0 110.751 -166.107 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.6 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 1.4 pp20? -33.99 -31.3 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -172.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.625 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -168.0 -76.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.357 169.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.817 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 159.94 142.74 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.225 164.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.595 ' CB ' HG21 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -126.54 -95.84 0.44 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.08 -164.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.613 ' O ' HD23 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -96.66 14.77 23.78 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.174 -178.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.045 ' CB ' ' HB2' ' A' ' 4' ' ' ALA . 54.4 mt -130.01 -62.52 0.94 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -172.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.817 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 60.7 t0 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.324 171.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.634 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 49.2 p . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.836 HG23 ' HB2' ' A' ' 11' ' ' ASP . 56.2 t -83.86 -92.94 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.016 168.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.602 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -146.22 -45.1 0.2 Allowed 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 165.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.694 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 55.15 -171.24 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.253 -173.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.59 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.69 35.66 0.02 OUTLIER 'General case' 0 C--N 1.35 0.627 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -174.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.731 ' CZ2' HG11 ' A' ' 2' ' ' VAL . 0.2 OUTLIER -147.82 -148.34 0.25 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.696 -167.467 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.427 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 11.2 mt-10 -36.61 -29.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -170.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.644 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -169.44 -68.61 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.905 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.828 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 159.61 120.17 0.0 OUTLIER 'General case' 0 C--O 1.235 0.307 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.653 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CD1' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -131.44 -71.78 0.56 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.227 -0.589 . . . . 0.0 111.13 -161.468 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.869 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -110.74 20.68 17.36 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.924 -0.485 . . . . 0.0 109.706 -169.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.869 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -172.51 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.473 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.828 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 11.8 t0 . . . . . 0 N--CA 1.455 -0.225 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.432 167.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.425 ' O ' HD11 ' A' ' 12' ' ' LEU . 61.7 p . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 1.034 HG21 ' CD2' ' A' ' 10' ' ' PHE . 55.0 t 37.91 -100.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 118.513 -0.756 . . . . 0.0 109.406 171.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 2' ' ' VAL . 3.4 tp60 -157.3 -61.34 0.09 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 171.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 1.004 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 76.99 -15.38 0.74 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.975 161.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.842 ' CD ' ' H ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -98.94 40.07 1.23 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 162.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.746 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -141.85 -145.25 0.17 Allowed 'General case' 0 C--N 1.349 0.581 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.162 -153.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.512 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.4 tm-20 -35.72 -31.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.928 -0.483 . . . . 0.0 110.077 -165.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.436 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -163.63 -75.86 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.34 170.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.843 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 175.63 133.77 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.404 163.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 1.034 ' CD2' HG21 ' A' ' 2' ' ' VAL . 88.4 t80 -112.53 -92.67 0.47 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.561 -164.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.555 ' HB3' ' CD2' ' A' ' 10' ' ' PHE . 6.5 p-10 -101.4 -14.72 17.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -169.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.004 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -104.68 -75.1 0.63 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.843 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 10.0 t0 . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 171.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 1.019 ' O ' HD11 ' A' ' 12' ' ' LEU . 1.5 m . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 1.169 HG21 ' CD2' ' A' ' 10' ' ' PHE . 76.4 t 38.63 -110.13 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.64 164.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.992 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -166.83 -31.41 0.03 OUTLIER 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 169.219 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.685 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.95 174.43 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.027 173.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 42.25 47.97 4.2 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -165.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -162.16 -148.46 0.14 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.022 -164.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.9 tp10 -36.69 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -168.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -105.57 -93.67 0.36 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.333 166.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.974 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . 164.97 160.99 0.02 OUTLIER 'General case' 0 C--N 1.34 0.188 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 161.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 1.169 ' CD2' HG21 ' A' ' 2' ' ' VAL . 8.8 m-85 -130.4 -84.69 0.53 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.272 -176.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 1.026 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -135.93 28.61 3.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.23 -167.26 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.026 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -160.42 30.98 0.16 Allowed 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 176.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.974 ' HB2' ' HB1' ' A' ' 9' ' ' ALA . 52.6 t0 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.424 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 119.41 -0.328 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.785 HG13 ' CH2' ' A' ' 6' ' ' TRP . 44.4 t -69.04 -99.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 117.671 -1.157 . . . . 0.0 108.719 167.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.73 ' O ' HD12 ' A' ' 12' ' ' LEU . 2.9 tp-100 -170.74 -36.21 0.02 OUTLIER 'General case' 0 C--O 1.235 0.312 0 CA-C-O 118.58 -0.724 . . . . 0.0 109.139 166.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.668 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 81.1 -62.88 0.19 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.073 168.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.493 ' CD ' ' H ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -78.7 63.92 3.58 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 116.342 -1.79 . . . . 0.0 106.853 174.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.785 ' CH2' HG13 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -164.87 -148.51 0.11 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.482 -155.261 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.0 mm-40 -44.33 -96.8 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.501 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -125.45 93.14 3.77 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.22 -0.895 . . . . 0.0 108.78 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 1.037 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -36.9 148.23 0.03 OUTLIER 'General case' 0 C--N 1.339 0.132 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -162.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.693 ' CB ' HG21 ' A' ' 2' ' ' VAL . 6.8 m-85 -129.03 -83.92 0.57 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.493 -167.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -105.21 -40.91 5.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.862 -167.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 1.034 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -72.88 -54.08 9.7 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 167.813 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 1.037 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.919 170.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 1.062 HG21 ' CD2' ' A' ' 10' ' ' PHE . 90.7 t -68.6 -100.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 117.535 -1.221 . . . . 0.0 108.881 167.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.661 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.55 -35.66 0.06 Allowed 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 165.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.759 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.29 173.56 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.949 176.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.591 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 45.04 49.81 9.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 -165.093 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.759 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -165.83 -148.71 0.1 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.091 -163.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -35.67 -71.07 0.08 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.314 -0.374 . . . . 0.0 110.046 -167.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.633 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -111.05 -93.26 0.45 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.087 164.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 163.97 151.57 0.02 OUTLIER 'General case' 0 C--N 1.339 0.115 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.858 160.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 1.062 ' CD2' HG21 ' A' ' 2' ' ' VAL . 14.0 m-85 -109.56 -60.27 1.8 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.201 -170.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -164.59 -40.96 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.61 -167.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 3' ' ' GLN . 0.2 OUTLIER -85.61 25.53 1.05 Allowed 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.749 ' CA ' ' HB1' ' A' ' 4' ' ' ALA . 22.9 t0 . . . . . 0 C--N 1.342 0.243 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.78 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.708 ' HA ' HD21 ' A' ' 12' ' ' LEU . 46.2 m . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 0.808 HG21 ' HB3' ' A' ' 10' ' ' PHE . 1.5 t -129.82 -77.96 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.415 170.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.841 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.1 tp-100 -151.86 -50.64 0.11 Allowed 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 164.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.704 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 70.9 -179.86 0.23 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 48.83 28.93 2.08 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -174.037 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.782 ' CH2' HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -155.43 -149.84 0.28 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.356 -160.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.506 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.6 mm-40 -38.59 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 43.87 -97.8 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -166.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.631 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . -177.05 140.46 0.3 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.358 165.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.808 ' HB3' HG21 ' A' ' 2' ' ' VAL . 3.4 m-85 -104.35 -91.83 0.37 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.397 -164.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.873 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -104.81 -12.62 16.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -170.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.873 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -111.0 -66.73 1.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.576 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.704 ' H ' ' HB2' ' A' ' 4' ' ' ALA . 46.9 t0 . . . . . 0 N--CA 1.453 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.773 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' SER . . . . . 0.628 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 2.2 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' VAL . . . . . 1.178 HG21 ' CD2' ' A' ' 10' ' ' PHE . 88.1 t 31.86 -101.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 117.261 -1.352 . . . . 0.0 108.945 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -160.43 -41.08 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 164.688 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.993 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 49.51 171.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.797 177.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CD ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 52.95 47.36 24.82 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -165.537 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.83 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -174.03 -151.76 0.05 OUTLIER 'General case' 0 C--N 1.348 0.51 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.853 -160.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.604 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 2.1 mt-10 -41.47 97.02 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -170.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 51.42 -94.25 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -165.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.495 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 174.19 134.58 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 167.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 1.178 ' CD2' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -83.56 -75.65 0.32 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.779 -167.428 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' ' C ' ' A' ' 12' ' ' LEU . 32.6 t70 -141.83 -77.71 0.27 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.793 -173.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.794 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -40.05 -41.09 1.17 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 174.077 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.993 ' HA ' ' HB1' ' A' ' 4' ' ' ALA . 6.5 t70 . . . . . 0 N--CA 1.452 -0.365 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.484 177.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.889 ' O ' HD11 ' A' ' 12' ' ' LEU . 57.8 m . . . . . 0 N--CA 1.473 0.694 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.136 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.997 HG21 ' CD2' ' A' ' 10' ' ' PHE . 61.1 t 63.55 -103.42 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.714 0 CA-C-O 116.341 -1.79 . . . . 0.0 107.739 -162.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.918 ' CB ' ' CD1' ' A' ' 6' ' ' TRP . 1.3 mt-30 -164.17 -36.26 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.125 0 O-C-N 121.975 -0.453 . . . . 0.0 110.088 162.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.984 ' HB1' ' N ' ' A' ' 13' ' ' ASP . . . 53.14 -176.35 0.03 OUTLIER 'General case' 0 C--N 1.341 0.218 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.578 -175.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.66 ' H ' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER 48.16 27.17 1.2 Allowed 'General case' 0 C--N 1.346 0.446 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -170.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.918 ' CD1' ' CB ' ' A' ' 3' ' ' GLN . 0.0 OUTLIER -162.29 -154.32 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 116.645 -1.645 . . . . 0.0 109.7 -162.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CD2' ' A' ' 6' ' ' TRP . 44.4 tt0 -32.51 96.01 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.115 -0.366 . . . . 0.0 110.842 -164.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 57.81 -92.95 0.04 OUTLIER 'General case' 0 C--N 1.344 0.333 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 -170.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.833 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 170.39 127.1 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 164.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.997 ' CD2' HG21 ' A' ' 2' ' ' VAL . 1.6 t80 -65.71 -53.93 34.21 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.5 t70 175.9 -30.49 0.0 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.889 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -82.26 12.43 4.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 117.569 -1.205 . . . . 0.0 110.177 178.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.984 ' N ' ' HB1' ' A' ' 4' ' ' ALA . 20.7 t0 -63.89 -5.51 4.53 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.37 -0.831 . . . . 0.0 109.849 166.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.524 ' N ' HD23 ' A' ' 14' ' ' LEU . 5.1 mt 59.8 78.82 0.25 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 116.951 -1.5 . . . . 0.0 109.781 177.008 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.989 ' O ' HD11 ' A' ' 12' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 118.801 -0.619 . . . . 0.0 110.458 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.766 HG12 ' H ' ' A' ' 3' ' ' GLN . 62.3 t 39.32 -107.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-O 117.616 -1.183 . . . . 0.0 109.152 166.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.766 ' H ' HG12 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -159.23 -33.57 0.06 Allowed 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 166.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.818 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 60.83 -179.95 0.1 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 114.524 -1.216 . . . . 0.0 109.229 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.593 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.77 43.47 0.1 Allowed 'General case' 0 C--N 1.349 0.563 0 C-N-CA 118.943 -1.103 . . . . 0.0 108.029 -175.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -154.09 -151.59 0.37 Allowed 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.543 -166.046 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.1 mt-10 -38.3 -81.18 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -172.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.497 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -131.22 87.9 2.53 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.755 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.02 156.13 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.93 -165.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.735 ' HD2' HG11 ' A' ' 2' ' ' VAL . 29.9 m-85 -142.41 -87.88 0.15 Allowed 'General case' 0 C--O 1.234 0.276 0 C-N-CA 120.041 -0.664 . . . . 0.0 110.649 -167.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.958 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.4 m-20 -85.49 7.32 23.31 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.031 -167.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.989 HD11 ' O ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -142.97 -48.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -176.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.942 ' O ' HD12 ' A' ' 14' ' ' LEU . 25.5 t70 39.57 51.67 2.3 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.38 173.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.942 HD12 ' O ' ' A' ' 13' ' ' ASP . 0.3 OUTLIER 78.68 111.3 0.07 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.677 -171.742 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.567 ' CD2' ' HB3' ' A' ' 12' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 116.857 -1.544 . . . . 0.0 109.754 172.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 1.067 ' HA ' HD21 ' A' ' 12' ' ' LEU . 3.2 p . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.717 HG11 ' CD2' ' A' ' 10' ' ' PHE . 57.9 t -73.84 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 171.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.782 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.9 OUTLIER -133.52 -39.87 0.89 Allowed 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.201 -1.036 . . . . 0.0 108.201 165.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.664 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 51.36 -175.11 0.02 OUTLIER 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.849 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.589 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 37.15 42.23 0.26 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 -170.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.664 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -156.45 -149.06 0.24 Allowed 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.103 -165.709 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.8 tp10 -50.81 -96.37 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -170.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.438 ' N ' ' HG3' ' A' ' 7' ' ' GLU . . . -100.33 81.87 2.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.916 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -41.12 147.6 0.13 Allowed 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -168.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.717 ' CD2' HG11 ' A' ' 2' ' ' VAL . 1.9 m-85 -119.32 -86.2 0.65 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.238 -167.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.534 ' C ' HD23 ' A' ' 12' ' ' LEU . 9.8 t0 -111.27 -17.01 13.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.868 -167.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.067 HD21 ' HA ' ' A' ' 1' ' ' SER . 0.1 OUTLIER -98.13 -38.06 9.47 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 172.295 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.916 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 2.0 p-10 37.68 29.67 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.706 170.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 23.8 mt -57.89 -27.73 63.56 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 172.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.5 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 5.3 m-85 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 116.879 -1.534 . . . . 0.0 109.853 175.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.97 ' CB ' HD21 ' A' ' 12' ' ' LEU . 2.4 p . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.595 HG21 ' CB ' ' A' ' 10' ' ' PHE . 1.5 t -93.22 -79.43 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 118.632 -0.699 . . . . 0.0 110.176 -166.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.596 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 2.5 tp60 -145.59 -35.51 0.3 Allowed 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 167.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 1.045 ' HB2' ' CB ' ' A' ' 12' ' ' LEU . . . 65.09 179.35 0.19 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 116.01 -1.948 . . . . 0.0 108.62 -172.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.588 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 31.72 40.13 0.01 OUTLIER 'General case' 0 C--N 1.35 0.626 0 O-C-N 120.238 -1.539 . . . . 0.0 108.717 178.716 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CE2' ' HG3' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -142.68 -153.3 0.46 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 118.592 -0.718 . . . . 0.0 110.751 -166.107 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.6 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 1.4 pp20? -33.99 -31.3 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -172.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.625 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -168.0 -76.38 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.357 169.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.817 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 159.94 142.74 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.225 164.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.595 ' CB ' HG21 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -126.54 -95.84 0.44 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.08 -164.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.613 ' O ' HD23 ' A' ' 12' ' ' LEU . 0.7 OUTLIER -96.66 14.77 23.78 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.174 -178.993 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.045 ' CB ' ' HB2' ' A' ' 4' ' ' ALA . 54.4 mt -130.01 -62.52 0.94 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -172.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.817 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 60.7 t0 39.55 56.52 2.27 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.324 171.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.638 ' H ' ' HB1' ' A' ' 4' ' ' ALA . 9.4 mt -97.2 41.96 1.1 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.706 -173.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.467 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 1.6 m-85 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 116.919 -1.515 . . . . 0.0 109.893 175.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.634 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 49.2 p . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.836 HG23 ' HB2' ' A' ' 11' ' ' ASP . 56.2 t -83.86 -92.94 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.016 168.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.602 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -146.22 -45.1 0.2 Allowed 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 165.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.694 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 55.15 -171.24 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.253 -173.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.59 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 34.69 35.66 0.02 OUTLIER 'General case' 0 C--N 1.35 0.627 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -174.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.731 ' CZ2' HG11 ' A' ' 2' ' ' VAL . 0.2 OUTLIER -147.82 -148.34 0.25 Allowed 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.696 -167.467 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.427 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 11.2 mt-10 -36.61 -29.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -170.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.644 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -169.44 -68.61 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.905 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.828 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 159.61 120.17 0.0 OUTLIER 'General case' 0 C--O 1.235 0.307 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.653 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.701 ' CD1' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -131.44 -71.78 0.56 Allowed 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.227 -0.589 . . . . 0.0 111.13 -161.468 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.869 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -110.74 20.68 17.36 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.924 -0.485 . . . . 0.0 109.706 -169.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.869 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -172.51 -43.98 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.473 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.828 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 11.8 t0 58.3 51.55 8.27 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.432 167.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.8 mt -103.53 160.03 15.09 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 116.907 -1.52 . . . . 0.0 109.84 -176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.425 ' O ' HD11 ' A' ' 12' ' ' LEU . 61.7 p . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 1.034 HG21 ' CD2' ' A' ' 10' ' ' PHE . 55.0 t 37.91 -100.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 118.513 -0.756 . . . . 0.0 109.406 171.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.7 ' N ' HG12 ' A' ' 2' ' ' VAL . 3.4 tp60 -157.3 -61.34 0.09 Allowed 'General case' 0 C--O 1.236 0.356 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 171.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 1.004 ' HB3' HD12 ' A' ' 12' ' ' LEU . . . 76.99 -15.38 0.74 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-O 119.052 -0.499 . . . . 0.0 111.975 161.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.842 ' CD ' ' H ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -98.94 40.07 1.23 Allowed 'General case' 0 C--O 1.239 0.518 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 162.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.746 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -141.85 -145.25 0.17 Allowed 'General case' 0 C--N 1.349 0.581 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.162 -153.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.4 tm-20 -35.72 -31.22 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.928 -0.483 . . . . 0.0 110.077 -165.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.436 ' N ' ' C ' ' A' ' 6' ' ' TRP . . . -163.63 -75.86 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.35 -0.833 . . . . 0.0 109.34 170.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.843 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . 175.63 133.77 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.404 163.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 1.034 ' CD2' HG21 ' A' ' 2' ' ' VAL . 88.4 t80 -112.53 -92.67 0.47 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.561 -164.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.555 ' HB3' ' CD2' ' A' ' 10' ' ' PHE . 6.5 p-10 -101.4 -14.72 17.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -169.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.004 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -104.68 -75.1 0.63 Allowed 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 174.388 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.843 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 10.0 t0 55.52 58.43 4.58 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 171.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.415 ' H ' HD12 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -93.84 45.56 1.15 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -172.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 1.2 p90 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 116.988 -1.482 . . . . 0.0 109.87 173.948 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 1.019 ' O ' HD11 ' A' ' 12' ' ' LEU . 1.5 m . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 1.169 HG21 ' CD2' ' A' ' 10' ' ' PHE . 76.4 t 38.63 -110.13 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.64 164.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.992 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.1 OUTLIER -166.83 -31.41 0.03 OUTLIER 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 169.219 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.685 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.95 174.43 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.027 173.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.592 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 42.25 47.97 4.2 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -165.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.765 ' CZ2' ' CG1' ' A' ' 2' ' ' VAL . 0.1 OUTLIER -162.16 -148.46 0.14 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.022 -164.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.9 tp10 -36.69 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -168.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -105.57 -93.67 0.36 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.333 166.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.974 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . 164.97 160.99 0.02 OUTLIER 'General case' 0 C--N 1.34 0.188 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.948 161.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 1.169 ' CD2' HG21 ' A' ' 2' ' ' VAL . 8.8 m-85 -130.4 -84.69 0.53 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.272 -176.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 1.026 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -135.93 28.61 3.19 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.23 -167.26 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.026 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -160.42 30.98 0.16 Allowed 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 176.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 1.019 ' C ' HD23 ' A' ' 14' ' ' LEU . 52.6 t0 -90.38 25.41 2.25 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.424 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 1.019 HD23 ' C ' ' A' ' 13' ' ' ASP . 0.1 OUTLIER -151.86 -69.62 0.17 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.741 -173.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 116.893 -1.527 . . . . 0.0 109.834 -178.236 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 119.41 -0.328 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.785 HG13 ' CH2' ' A' ' 6' ' ' TRP . 44.4 t -69.04 -99.22 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 117.671 -1.157 . . . . 0.0 108.719 167.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.73 ' O ' HD12 ' A' ' 12' ' ' LEU . 2.9 tp-100 -170.74 -36.21 0.02 OUTLIER 'General case' 0 C--O 1.235 0.312 0 CA-C-O 118.58 -0.724 . . . . 0.0 109.139 166.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.668 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 81.1 -62.88 0.19 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.073 168.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.493 ' CD ' ' H ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -78.7 63.92 3.58 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 116.342 -1.79 . . . . 0.0 106.853 174.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.785 ' CH2' HG13 ' A' ' 2' ' ' VAL . 0.0 OUTLIER -164.87 -148.51 0.11 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.482 -155.261 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.683 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 6.0 mm-40 -44.33 -96.8 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.501 ' O ' ' CD2' ' A' ' 10' ' ' PHE . . . -125.45 93.14 3.77 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 118.22 -0.895 . . . . 0.0 108.78 177.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 1.037 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -36.9 148.23 0.03 OUTLIER 'General case' 0 C--N 1.339 0.132 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.821 -162.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.693 ' CB ' HG21 ' A' ' 2' ' ' VAL . 6.8 m-85 -129.03 -83.92 0.57 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 118.976 -0.535 . . . . 0.0 110.493 -167.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.1 t0 -105.21 -40.91 5.7 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.862 -167.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 1.034 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -72.88 -54.08 9.7 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 167.813 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 1.037 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER 66.41 5.8 3.96 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.919 170.305 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' C ' ' CD1' ' A' ' 14' ' ' LEU . 0.2 OUTLIER 168.66 49.05 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 169.466 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.618 ' HD2' HD13 ' A' ' 12' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.122 0 CA-C-O 116.831 -1.557 . . . . 0.0 109.825 179.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.473 0.702 0 CA-C-O 119.422 -0.323 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 1.062 HG21 ' CD2' ' A' ' 10' ' ' PHE . 90.7 t -68.6 -100.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.377 0 CA-C-O 117.535 -1.221 . . . . 0.0 108.881 167.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.661 ' O ' HD12 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -159.55 -35.66 0.06 Allowed 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 165.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.759 ' HA ' ' CD1' ' A' ' 6' ' ' TRP . . . 47.29 173.56 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.949 176.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.591 ' CD ' ' O ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 45.04 49.81 9.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 -165.093 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.759 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -165.83 -148.71 0.1 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.091 -163.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -35.67 -71.07 0.08 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 119.314 -0.374 . . . . 0.0 110.046 -167.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.633 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . -111.05 -93.26 0.45 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 117.278 -1.344 . . . . 0.0 108.087 164.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 163.97 151.57 0.02 OUTLIER 'General case' 0 C--N 1.339 0.115 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.858 160.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 1.062 ' CD2' HG21 ' A' ' 2' ' ' VAL . 14.0 m-85 -109.56 -60.27 1.8 Allowed 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.201 -170.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -164.59 -40.96 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.61 -167.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.661 HD12 ' O ' ' A' ' 3' ' ' GLN . 0.2 OUTLIER -85.61 25.53 1.05 Allowed 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 177.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.749 ' CA ' ' HB1' ' A' ' 4' ' ' ALA . 22.9 t0 -55.97 -14.14 2.34 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.78 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.642 HD23 ' C ' ' A' ' 13' ' ' ASP . 0.4 OUTLIER -176.18 39.37 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 174.976 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.489 ' CD2' ' O ' ' A' ' 14' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.94 -1.505 . . . . 0.0 109.809 -174.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.708 ' HA ' HD21 ' A' ' 12' ' ' LEU . 46.2 m . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.808 HG21 ' HB3' ' A' ' 10' ' ' PHE . 1.5 t -129.82 -77.96 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-O 117.372 -1.299 . . . . 0.0 109.415 170.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.841 ' O ' HD12 ' A' ' 12' ' ' LEU . 1.1 tp-100 -151.86 -50.64 0.11 Allowed 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 164.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.704 ' HB2' ' H ' ' A' ' 13' ' ' ASP . . . 70.9 -179.86 0.23 Allowed 'General case' 0 C--N 1.34 0.179 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.633 ' HG2' HD11 ' A' ' 14' ' ' LEU . 0.0 OUTLIER 48.83 28.93 2.08 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -174.037 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.782 ' CH2' HG12 ' A' ' 2' ' ' VAL . 0.1 OUTLIER -155.43 -149.84 0.28 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.356 -160.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.506 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 19.6 mm-40 -38.59 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 -176.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 6' ' ' TRP . . . 43.87 -97.8 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -166.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.631 ' HB1' ' CB ' ' A' ' 13' ' ' ASP . . . -177.05 140.46 0.3 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.358 165.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.808 ' HB3' HG21 ' A' ' 2' ' ' VAL . 3.4 m-85 -104.35 -91.83 0.37 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.397 -164.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.873 ' C ' HD23 ' A' ' 12' ' ' LEU . 0.4 OUTLIER -104.81 -12.62 16.2 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -170.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.873 HD23 ' C ' ' A' ' 11' ' ' ASP . 0.0 OUTLIER -111.0 -66.73 1.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -178.576 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.704 ' H ' ' HB2' ' A' ' 4' ' ' ALA . 46.9 t0 50.33 19.51 0.54 Allowed 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.773 178.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.633 HD11 ' HG2' ' A' ' 5' ' ' ARG . 31.6 mt 38.83 32.13 0.05 Allowed 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 123.122 0.263 . . . . 0.0 110.768 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.501 ' CD1' ' C ' ' A' ' 15' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.059 0 CA-C-O 116.941 -1.504 . . . . 0.0 109.788 -173.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.628 ' HA ' ' CD2' ' A' ' 12' ' ' LEU . 2.2 m . . . . . 0 N--CA 1.473 0.708 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 1.178 HG21 ' CD2' ' A' ' 10' ' ' PHE . 88.1 t 31.86 -101.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-O 117.261 -1.352 . . . . 0.0 108.945 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.64 ' CB ' ' CE3' ' A' ' 6' ' ' TRP . 0.0 OUTLIER -160.43 -41.08 0.05 OUTLIER 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 164.688 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.993 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . 49.51 171.24 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.797 177.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.584 ' CD ' ' O ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER 52.95 47.36 24.82 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -165.537 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.83 ' CD1' ' HA ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER -174.03 -151.76 0.05 OUTLIER 'General case' 0 C--N 1.348 0.51 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.853 -160.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.604 ' N ' ' CG ' ' A' ' 6' ' ' TRP . 2.1 mt-10 -41.47 97.02 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -170.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 9' ' ' ALA . . . 51.42 -94.25 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -165.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.495 ' HB2' ' O ' ' A' ' 8' ' ' ALA . . . 174.19 134.58 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 167.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 1.178 ' CD2' HG21 ' A' ' 2' ' ' VAL . 0.5 OUTLIER -83.56 -75.65 0.32 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.779 -167.428 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.408 ' O ' ' C ' ' A' ' 12' ' ' LEU . 32.6 t70 -141.83 -77.71 0.27 Allowed 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.793 -173.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.794 HD12 ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -40.05 -41.09 1.17 Allowed 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 174.077 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.993 ' HA ' ' HB1' ' A' ' 4' ' ' ALA . 6.5 t70 33.84 57.24 0.58 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.484 177.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 14' ' ' LEU . 4.1 pp -171.19 31.2 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.132 -174.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.553 ' CG ' ' C ' ' A' ' 14' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.195 0 CA-C-O 116.543 -1.694 . . . . 0.0 109.593 -170.699 . . . . . . . . 2 2 . 1 stop_ save_