data_1nsh_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 1nsh _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 ' 4' ' ' THR . . . . . 0.514 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.519 -0.238 0 CA-C-O 121.477 0.656 . . . . 0.0 111.485 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.75 -41.31 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.211 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.516 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.5 m -71.08 -39.41 72.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.227 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.514 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 1.2 mm-40 -51.92 -53.34 42.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.422 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -65.94 -26.64 67.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.184 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.461 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 0.3 OUTLIER -64.92 -49.86 68.75 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.353 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.577 HG12 HD12 ' B' ' 80' ' ' ILE . 2.8 mp -61.47 -57.16 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.744 0.307 . . . . 0.0 111.556 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.466 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -52.89 -27.42 18.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.754 -179.286 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.492 ' O ' HG11 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.85 -55.44 22.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.702 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.9 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.3 mm? -74.22 -28.61 61.33 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -178.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.787 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 6.3 mt -66.88 -37.06 78.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.336 0.589 . . . . 0.0 111.398 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.93 49.06 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.692 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.9 HG21 ' O ' ' A' ' 13' ' ' LEU . 24.3 m -52.24 -37.55 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.561 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 3.5 t80 -77.1 -57.95 3.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.277 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.3 mm-40 -48.98 -47.21 44.37 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.66 -51.8 20.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.69 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 38' ' ' PHE . 1.5 m-85 -81.18 -29.76 34.55 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.617 0.722 . . . . 0.0 110.373 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 17' ' ' PHE . . . -84.11 12.96 5.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.281 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.749 179.9 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.761 0.315 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.427 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 1.2 p -129.86 -172.17 2.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.48 ' HG ' ' CA ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -142.71 -121.77 0.09 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.868 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.31 130.96 0.6 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.419 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 20.8 mtmt -50.02 -41.39 47.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 111.088 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -55.97 -28.79 58.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.106 0.479 . . . . 0.0 110.133 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -69.63 -31.98 70.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.104 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.6 mm? -53.12 -59.07 5.01 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.756 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.1 p -59.58 -41.8 91.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.645 -1.162 . . . . 0.0 111.866 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.438 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 78.8 t80 -57.87 -46.97 84.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.87 0.367 . . . . 0.0 111.339 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.483 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -59.93 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.188 -179.549 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -73.3 -19.67 60.99 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 38' ' ' PHE . 6.8 t -98.99 -31.07 11.99 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 1.3 mt-10 -132.39 23.82 4.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -177.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 11.8 mt -163.18 52.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.494 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.27 -27.31 59.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.475 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.65 -20.03 59.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 36.7 m-85 -97.61 -30.03 13.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 -179.58 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.7 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.411 ' CD2' ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.3 -51.54 13.0 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.726 -179.322 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.411 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 5.0 t70 -55.28 -38.39 68.53 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.397 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.0 -32.89 61.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.689 0.28 . . . . 0.0 111.685 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.517 ' CG ' ' HA ' ' A' ' 79' ' ' LEU . 8.3 tmm? -73.95 -53.06 10.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.563 ' HG2' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.658 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.687 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.451 ' HA ' HE21 ' A' ' 70' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.8 0.333 . . . . 0.0 111.483 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.439 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER -62.29 -134.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.032 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.439 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 3.0 t0 178.58 -171.15 0.12 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 118.569 0.622 . . . . 0.0 111.623 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.555 ' CG ' HG13 ' B' ' 85' ' ' VAL . 41.3 p90 -83.31 -57.75 3.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.27 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 78' ' ' ASN . 47.4 tp60 -76.1 -30.71 58.38 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.78 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.69 ' O ' HD22 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -44.7 -42.32 7.51 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.427 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 1.7 t80 -70.01 -54.37 13.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.936 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.427 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 6.0 mt -53.58 -33.57 55.29 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.3 m-20 -74.68 -40.84 61.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.296 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.69 HD22 ' O ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.05 -57.81 7.7 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.573 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.64 -42.51 48.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.045 179.125 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.427 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.86 -50.94 48.23 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.185 -1.007 . . . . 0.0 111.066 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.435 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.37 -41.82 63.51 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.365 -0.922 . . . . 0.0 111.843 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 3.2 mt -61.21 -42.29 98.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.473 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -54.46 -33.19 59.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.428 0.632 . . . . 0.0 110.338 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.559 HG13 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.55 -17.77 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.466 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.59 13.68 20.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.424 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 10.9 t -154.58 -43.32 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.781 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.473 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -93.87 -164.73 1.21 Allowed 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.705 0.288 . . . . 0.0 110.917 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.421 ' O ' ' CB ' ' A' ' 90' ' ' SER . 8.5 mt-10 -58.34 -163.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.908 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER 81.62 -57.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.026 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.13 -45.16 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.788 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.797 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.514 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.434 0.635 . . . . 0.0 111.538 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.67 -41.3 6.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.225 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.512 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.5 m -71.13 -39.39 72.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.233 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.514 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 1.3 mm-40 -51.95 -53.35 42.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.834 0.35 . . . . 0.0 110.369 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 53.1 mtm180 -65.88 -26.65 67.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.176 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.461 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -64.98 -49.84 68.7 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.316 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.573 HG12 HD12 ' A' ' 80' ' ' ILE . 2.8 mp -61.58 -57.07 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.702 0.287 . . . . 0.0 111.56 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.453 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -52.85 -27.5 18.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.728 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.496 ' O ' HG11 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.81 -55.51 22.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.3 mm? -74.16 -28.63 61.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.775 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 6.3 mt -66.92 -37.0 78.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 O-C-N 121.722 -0.611 . . . . 0.0 111.428 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.37 -32.98 49.21 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.823 -1.081 . . . . 0.0 112.729 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.902 HG21 ' O ' ' B' ' 13' ' ' LEU . 24.0 m -52.13 -37.62 22.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.574 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 3.5 t80 -77.03 -58.02 3.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.137 -1.392 . . . . 0.0 110.252 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.775 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.4 mm-40 -49.03 -47.2 44.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.58 -51.9 19.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.668 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.439 ' CE1' ' HB2' ' B' ' 38' ' ' PHE . 1.5 m-85 -81.1 -29.83 34.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.58 0.705 . . . . 0.0 110.45 178.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 17' ' ' PHE . . . -84.03 12.97 5.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.628 -1.169 . . . . 0.0 112.346 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.734 179.835 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.751 0.31 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.409 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 1.2 p -129.84 -172.07 2.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.753 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.475 ' HG ' ' CA ' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -142.83 -121.7 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.865 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.38 130.96 0.59 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.422 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 20.8 mtmt -49.96 -41.41 46.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.124 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.982 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.405 ' HB3' ' CD2' ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.98 -28.75 58.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.071 0.462 . . . . 0.0 110.121 179.678 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.513 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -69.66 -32.06 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.055 178.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.6 mm? -53.08 -59.03 5.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.803 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 3.1 p -59.63 -41.74 91.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.919 -178.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.439 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 78.8 t80 -57.88 -46.98 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 111.311 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.486 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -59.91 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 -179.534 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -73.33 -19.7 60.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.448 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.431 ' CG2' ' HA ' ' B' ' 38' ' ' PHE . 6.9 t -98.98 -31.08 11.99 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.416 ' CG ' ' CG2' ' B' ' 41' ' ' THR . 1.3 mt-10 -132.32 23.84 4.46 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.486 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 11.8 mt -163.18 52.93 0.17 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.002 0.429 . . . . 0.0 110.399 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 -27.33 59.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.485 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.62 -19.92 59.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.598 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.418 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 37.0 m-85 -97.74 -30.11 12.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 -179.642 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 32.7 t . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 121.033 0.444 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.32 -51.5 13.06 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.727 -179.259 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . 0.402 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 5.0 t70 -55.36 -38.47 68.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.32 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.89 61.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.731 0.3 . . . . 0.0 111.666 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.516 ' CG ' ' HA ' ' B' ' 79' ' ' LEU . 8.3 tmm? -74.05 -52.95 11.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.562 ' HG2' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.739 -178.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.452 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.804 0.335 . . . . 0.0 111.464 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.44 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.4 OUTLIER -62.36 -134.97 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.95 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.44 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 3.1 t0 178.64 -171.12 0.12 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.494 0.588 . . . . 0.0 111.532 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.559 ' CG ' HG13 ' A' ' 85' ' ' VAL . 41.6 p90 -83.2 -57.8 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.274 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.479 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 47.4 tp60 -76.1 -30.68 58.35 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.761 -179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.685 ' O ' HD22 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -44.75 -42.34 7.63 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.513 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.7 t80 -70.0 -54.28 13.9 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.983 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.426 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 6.0 mt -53.58 -33.6 55.39 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.3 m-20 -74.76 -40.7 61.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.312 178.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.685 HD22 ' O ' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -65.06 -57.84 7.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.434 -179.388 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.577 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.73 -42.39 47.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.082 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.98 -50.89 49.18 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.06 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.446 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.34 -41.86 63.27 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.787 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 3.2 mt -61.2 -42.23 98.23 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.921 0.391 . . . . 0.0 110.135 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.47 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -54.57 -33.13 59.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.414 0.626 . . . . 0.0 110.327 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.555 HG13 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.373 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.71 13.78 19.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.112 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.418 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 10.9 t -154.65 -43.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.841 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.47 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -94.09 -164.78 1.21 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.784 0.326 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' B' ' 90' ' ' SER . 8.7 mt-10 -58.34 -163.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.887 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' SER . . . . . 0.427 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 0.4 OUTLIER 81.61 -57.42 0.25 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.012 -179.799 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.11 -45.19 2.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.888 0.375 . . . . 0.0 110.829 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 179.92 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.417 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.307 0.575 . . . . 0.0 111.076 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.87 -44.58 9.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.322 -0.853 . . . . 0.0 111.056 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.495 ' O ' ' SG ' ' A' ' 9' ' ' CYS . 0.2 OUTLIER -65.2 -40.45 94.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.914 178.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -50.98 -36.05 37.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.575 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.73 -26.89 40.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.582 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 6' ' ' THR . 1.7 p -68.07 -41.95 81.15 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.639 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.641 ' O ' HG13 ' A' ' 14' ' ' ILE . 3.4 mp -72.09 -54.51 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.53 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.66 -27.35 11.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.541 ' O ' HG12 ' A' ' 16' ' ' VAL . 52.2 m -77.59 -56.03 4.87 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.771 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.636 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.7 mm? -57.95 -27.85 63.78 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.968 0.413 . . . . 0.0 111.778 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.641 HG13 ' O ' ' A' ' 10' ' ' ILE . 13.4 mt -71.81 -39.57 68.2 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-O 121.573 0.701 . . . . 0.0 110.512 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.572 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -77.47 -38.26 49.62 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.935 -1.484 . . . . 0.0 112.084 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 13' ' ' LEU . 25.6 m -52.6 -33.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.697 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.6 t80 -80.51 -58.48 3.1 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.943 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.645 ' HA ' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.47 -27.53 64.3 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.899 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -50.28 72.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.202 0.525 . . . . 0.0 109.685 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.529 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 3.1 m-85 -79.44 -28.47 41.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.479 178.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.697 ' HB1' ' O ' ' A' ' 17' ' ' PHE . . . -80.36 2.19 25.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.016 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.633 179.737 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.465 0.308 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -139.29 -179.8 6.08 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.813 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.618 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.3 0.19 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.435 -179.698 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.522 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 28.8 t -173.63 126.71 0.4 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.121 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.82 -36.34 26.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.422 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.09 -43.08 58.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.072 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.522 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.24 59.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 110.154 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.559 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -72.92 -29.45 63.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.908 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -59.13 -59.24 5.78 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.545 0.688 . . . . 0.0 111.507 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.7 t -68.03 -50.41 55.53 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.464 -178.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.529 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.8 m-85 -57.93 -25.89 61.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.228 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.443 ' HE1' ' CE1' ' A' ' 35' ' ' PHE . 1.5 ttm -78.17 -53.66 7.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.056 0.455 . . . . 0.0 110.531 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -57.84 -19.69 30.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.095 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.436 ' CG2' ' HG2' ' A' ' 42' ' ' GLU . 9.2 t -96.87 -30.28 13.23 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.3 OUTLIER -125.94 -42.18 1.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' A' ' 39' ' ' MET . 7.4 mt -101.88 34.94 2.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.315 0.579 . . . . 0.0 110.162 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.16 -28.84 34.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.924 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.55 -25.54 17.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' ' CE1' ' A' ' 88' ' ' HIS . 4.5 m-85 -102.32 17.05 24.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.088 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.333 -0.137 0 CA-C-O 120.901 0.382 . . . . 0.0 110.992 -179.964 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.56 -50.94 63.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.663 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -57.01 -26.69 60.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.064 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -50.05 75.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.827 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.544 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 1.3 ptp -56.36 -53.5 56.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.062 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.526 ' N ' ' CG ' ' A' ' 59' ' ' MET . 3.6 mmt . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.891 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.413 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.626 0.25 . . . . 0.0 110.846 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -63.27 -135.41 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.485 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER 172.79 -168.7 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.761 0.71 . . . . 0.0 111.753 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.52 ' CG ' HG12 ' B' ' 85' ' ' VAL . 31.8 p90 -76.21 -60.71 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.612 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.496 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.32 -25.61 39.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.438 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.4 OUTLIER -46.4 -31.77 2.84 Favored 'General case' 0 CA--C 1.522 -0.124 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.683 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.559 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 2.5 t80 -80.33 -54.35 5.8 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.856 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.449 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 7.3 mt -55.95 -33.52 64.81 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.726 179.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.432 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -75.85 -37.46 58.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.1 mp -66.08 -58.19 6.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.023 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.628 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.08 -44.77 49.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.562 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.449 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.82 -49.31 54.79 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.448 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.58 -43.59 53.2 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.363 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 6.4 mt -56.85 -44.84 82.53 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 110.018 178.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.473 ' O ' ' N ' ' A' ' 89' ' ' GLU . . . -55.47 -41.62 73.21 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.186 0.517 . . . . 0.0 110.913 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.665 ' HA ' ' HB2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -73.74 -17.11 17.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.285 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -109.11 16.37 22.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.565 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 44.8 t -158.38 -35.88 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.514 ' HB3' HD11 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -118.35 -67.87 0.96 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.665 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 2.1 mm-40 -36.55 156.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.128 0.49 . . . . 0.0 112.234 -178.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.19 66.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.146 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.41 -48.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.718 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.135 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.217 0 CA-C-O 121.363 0.601 . . . . 0.0 110.966 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.83 -44.66 9.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.502 ' O ' ' SG ' ' B' ' 9' ' ' CYS . 0.2 OUTLIER -65.21 -40.43 94.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.824 178.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.05 -36.14 38.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.47 -179.826 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.71 -26.82 40.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.636 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' B' ' 6' ' ' THR . 1.6 p -67.93 -42.15 81.48 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.641 ' O ' HG13 ' B' ' 14' ' ' ILE . 3.4 mp -71.93 -54.52 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.629 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.445 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.76 -27.23 11.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.545 ' O ' HG12 ' B' ' 16' ' ' VAL . 52.2 m -77.69 -56.0 4.88 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.819 -0.352 . . . . 0.0 111.755 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.645 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.7 mm? -57.9 -27.8 63.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.991 0.424 . . . . 0.0 111.796 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.641 HG13 ' O ' ' B' ' 10' ' ' ILE . 13.7 mt -71.96 -39.58 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 CA-C-O 121.481 0.658 . . . . 0.0 110.417 178.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . 0.582 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -77.42 -38.31 49.91 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.967 -1.47 . . . . 0.0 112.105 -176.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 13' ' ' LEU . 25.3 m -52.56 -33.61 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.702 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.6 t80 -80.4 -58.66 3.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.436 -1.256 . . . . 0.0 112.897 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.672 ' HA ' ' HB1' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.38 -27.54 64.4 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -50.3 72.12 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.522 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 3.1 m-85 -79.35 -28.55 42.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.515 178.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.702 ' HB1' ' O ' ' B' ' 17' ' ' PHE . . . -80.4 2.41 25.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.103 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.71 179.747 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -139.33 -179.91 6.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.967 0.413 . . . . 0.0 110.773 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.611 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.21 0.19 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.503 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 28.7 t -173.7 126.56 0.39 Allowed 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.812 0.339 . . . . 0.0 110.092 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.406 ' N ' HD23 ' B' ' 71' ' ' LEU . 0.4 OUTLIER -49.68 -36.43 25.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.459 -179.174 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.642 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.07 -43.06 59.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.061 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.503 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.25 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.98 0.419 . . . . 0.0 110.094 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.545 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -72.91 -29.43 63.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.941 179.073 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.642 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -59.19 -59.16 5.91 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.562 0.696 . . . . 0.0 111.565 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 33.6 t -67.95 -50.42 55.98 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.528 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.522 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.9 m-85 -57.99 -25.96 61.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.129 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.435 ' HE1' ' CE1' ' B' ' 35' ' ' PHE . 1.5 ttm -78.16 -53.61 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.047 0.451 . . . . 0.0 110.541 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -57.84 -19.65 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.149 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.44 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 9.2 t -96.83 -30.32 13.23 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.44 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.4 OUTLIER -125.9 -42.15 1.92 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.572 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' B' ' 39' ' ' MET . 7.4 mt -101.89 34.99 2.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.291 0.567 . . . . 0.0 110.053 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.27 -28.77 34.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.903 -179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.62 -25.51 17.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.801 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.421 ' CZ ' ' CE1' ' B' ' 88' ' ' HIS . 4.5 m-85 -102.29 16.96 24.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.08 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.332 -0.156 0 CA-C-O 120.864 0.364 . . . . 0.0 111.003 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.0 t . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.804 0.335 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.51 -51.06 62.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -56.93 -26.76 60.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.063 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -50.0 75.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.818 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.538 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 1.3 ptp -56.34 -53.53 56.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.086 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.529 ' N ' ' CG ' ' B' ' 59' ' ' MET . 3.6 mmt . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.879 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.403 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.517 0.199 . . . . 0.0 110.864 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.486 ' O ' ' HB2' ' B' ' 72' ' ' ASP . 0.2 OUTLIER -63.39 -135.42 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.484 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.486 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 0.8 OUTLIER 172.91 -168.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.819 0.736 . . . . 0.0 111.756 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.52 ' CG ' HG12 ' A' ' 85' ' ' VAL . 31.8 p90 -76.31 -60.62 2.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.568 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.507 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.38 -25.53 39.08 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.441 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.4 OUTLIER -46.46 -31.75 2.88 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.545 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 2.5 t80 -80.29 -54.45 5.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.805 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.445 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 7.2 mt -55.93 -33.54 64.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.68 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.411 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.2 OUTLIER -75.82 -37.43 59.09 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.538 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.1 mp -66.06 -58.2 6.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.111 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.612 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.1 -44.77 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.54 179.047 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.8 -49.3 54.7 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 178.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.441 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.44 -43.62 52.34 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.44 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 6.4 mt -56.86 -44.85 82.58 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 110.025 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' GLU . . . -55.45 -41.66 73.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.205 0.526 . . . . 0.0 110.897 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.664 ' HA ' ' HB2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -73.69 -17.27 17.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.209 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -108.95 16.37 22.7 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.54 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 44.6 t -158.38 -35.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.528 ' HB3' HD11 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -118.29 -67.79 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.664 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 2.1 mm-40 -36.52 156.47 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.14 66.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.159 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.49 -49.01 0.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.723 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.923 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.414 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.34 0.59 . . . . 0.0 111.254 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.91 -41.78 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.97 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.473 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.5 OUTLIER -67.94 -38.75 83.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.048 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.414 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.4 -33.46 30.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.437 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -27.11 41.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.562 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 1.4 p -69.07 -45.16 71.03 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.615 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -65.98 -56.37 15.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.49 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.578 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.17 -27.27 13.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.674 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.487 ' HB3' ' HB2' ' B' ' 9' ' ' CYS . 0.3 OUTLIER -69.84 -55.52 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.82 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.856 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 8.3 mt -69.47 -35.45 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-O 121.216 0.531 . . . . 0.0 110.778 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.37 51.21 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.538 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.82 HG22 ' O ' ' A' ' 13' ' ' LEU . 29.6 m -63.53 -37.11 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.167 0.508 . . . . 0.0 109.943 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.553 ' N ' HG21 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -80.53 -60.1 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.847 -178.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -58.18 -26.66 63.04 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.36 -52.16 48.12 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.306 -0.557 . . . . 0.0 109.708 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.436 ' CE2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m-85 -80.53 -29.77 37.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.62 0.724 . . . . 0.0 109.235 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.581 ' HA ' HD22 ' A' ' 30' ' ' LEU . . . -83.3 20.08 1.38 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.523 -1.217 . . . . 0.0 112.218 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.501 179.931 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.886 0.374 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.55 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 5.9 p -146.11 158.76 43.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.09 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.587 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -117.39 -156.16 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.893 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.88 136.45 37.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -49.86 -39.78 40.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.688 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.634 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.31 -44.58 51.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.28 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.436 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 1.3 tt0 -59.81 -29.14 68.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 0.0 109.941 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.558 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -75.59 -26.61 58.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.552 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.634 ' HB2' ' O ' ' A' ' 33' ' ' THR . 2.4 mm? -51.35 -59.26 4.42 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.686 0.755 . . . . 0.0 110.647 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.15 69.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.477 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 12.5 t80 -57.84 -28.98 64.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.402 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.448 ' CE ' ' CD1' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -78.0 -35.94 49.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.055 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -73.21 -19.78 61.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.212 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.78 -78.57 0.59 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.139 0.495 . . . . 0.0 111.606 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 1.9 mm-40 -51.36 -28.41 12.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.032 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.3 mt -134.57 51.48 2.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 110.478 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.75 -25.39 53.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.86 -14.52 63.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.134 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.42 -21.54 15.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.26 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.377 -179.625 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.898 0.38 . . . . 0.0 111.386 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -51.1 70.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.756 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.82 -30.89 62.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.372 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -42.75 92.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.008 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.523 ' CG ' ' N ' ' A' ' 60' ' ' MET . 0.4 OUTLIER -63.43 -53.54 50.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.339 -179.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.523 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.298 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.55 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.695 0.283 . . . . 0.0 111.062 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.587 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -65.9 -136.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.443 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.03 -164.9 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.602 0.637 . . . . 0.0 111.603 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.584 ' HB2' HG13 ' B' ' 85' ' ' VAL . 43.3 p90 -81.71 -57.2 3.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.357 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.492 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 44.6 tp60 -80.35 -27.91 38.2 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.325 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.78 -36.59 3.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.603 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 2.0 t80 -80.38 -54.24 5.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.036 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 81' ' ' GLY . 5.5 mt -50.12 -34.55 22.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.492 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.84 -38.46 53.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.603 ' HB2' ' HA ' ' A' ' 76' ' ' PHE . 1.8 mp -63.82 -58.15 7.7 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.798 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.545 ' HA ' ' HG ' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -72.6 -42.37 63.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.174 178.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.92 51.81 Favored Glycine 0 CA--C 1.507 -0.446 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.479 ' O ' HG22 ' A' ' 85' ' ' VAL . . . -51.54 -40.26 46.91 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.426 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HG ' ' HA ' ' A' ' 80' ' ' ILE . 6.3 mt -60.26 -45.53 92.95 Favored 'General case' 0 C--O 1.23 0.056 0 O-C-N 122.571 -0.37 . . . . 0.0 110.327 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.44 -30.76 61.11 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.175 0.512 . . . . 0.0 110.843 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.6 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.99 -17.48 9.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.168 -179.657 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.31 12.83 17.7 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.199 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.14 -37.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.506 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.466 ' CG ' HD13 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -89.37 -171.08 3.09 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.913 0.387 . . . . 0.0 111.3 -179.686 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.61 55.18 3.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.4 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.458 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.6 OUTLIER -117.57 -47.68 2.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.953 0.406 . . . . 0.0 110.412 179.377 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.493 ' O ' HG22 ' A' ' 92' ' ' VAL . 0.7 OUTLIER -135.37 -81.55 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.423 179.289 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 91' ' ' PHE . 7.2 m . . . . . 0 CA--C 1.531 0.239 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.416 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 121.342 0.592 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -41.76 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.953 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.482 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.5 OUTLIER -68.0 -38.71 82.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.029 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.416 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.31 -33.56 29.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.469 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.59 -27.17 41.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.519 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 1.4 p -69.08 -45.1 71.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.211 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.618 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -66.09 -56.31 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.404 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.563 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.24 -27.21 13.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.679 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.496 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -69.9 -55.56 9.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.32 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.809 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -68.51 -27.25 65.95 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.855 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 8.3 mt -69.42 -35.47 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-O 121.217 0.532 . . . . 0.0 110.832 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.38 51.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.408 -1.269 . . . . 0.0 112.613 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.809 HG22 ' O ' ' B' ' 13' ' ' LEU . 29.3 m -63.46 -37.2 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 109.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.548 ' N ' HG21 ' B' ' 16' ' ' VAL . 0.0 OUTLIER -80.48 -60.02 2.48 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.881 -178.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.855 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.1 OUTLIER -58.19 -26.75 63.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.28 -52.08 48.29 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.737 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.441 ' CE2' ' O ' ' B' ' 34' ' ' GLU . 2.8 m-85 -80.64 -29.8 36.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.656 0.741 . . . . 0.0 109.215 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.562 ' HA ' HD22 ' B' ' 30' ' ' LEU . . . -83.3 20.13 1.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.172 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.533 179.885 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 120.969 0.414 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.532 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 5.8 p -146.19 158.75 43.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.034 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.592 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.0 OUTLIER -117.43 -156.14 0.62 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.88 179.598 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.89 136.41 37.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.947 0.403 . . . . 0.0 110.545 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -49.87 -39.75 40.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.673 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.637 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.29 -44.67 51.75 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.27 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.441 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 1.3 tt0 -59.88 -28.98 68.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.223 0.535 . . . . 0.0 109.987 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.556 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -75.6 -26.61 57.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.58 179.415 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.637 ' HB2' ' O ' ' B' ' 33' ' ' THR . 2.4 mm? -51.49 -59.21 4.51 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.709 0.766 . . . . 0.0 110.571 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.17 69.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.422 -1.263 . . . . 0.0 110.407 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.466 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 12.6 t80 -57.92 -28.86 64.65 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.389 179.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.439 ' CE ' ' CD1' ' B' ' 83' ' ' LEU . 0.0 OUTLIER -78.14 -35.84 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.942 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -73.26 -19.79 60.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.178 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.81 -78.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 111.602 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.466 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 1.9 mm-40 -51.34 -28.39 12.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.082 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -134.64 51.56 2.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.033 0.444 . . . . 0.0 110.482 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 -25.35 53.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.932 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.78 -14.52 63.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.174 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.45 -21.5 15.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.2 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.412 -179.645 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.893 0.377 . . . . 0.0 111.391 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -50.97 70.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.85 -30.91 62.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.347 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -42.79 92.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.528 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 0.4 OUTLIER -63.48 -53.51 51.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.32 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.52 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.299 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.532 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.766 0.317 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.592 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.4 OUTLIER -65.83 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.419 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 172.01 -164.89 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.574 0.625 . . . . 0.0 111.613 179.512 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.6 ' HB2' HG13 ' A' ' 85' ' ' VAL . 43.4 p90 -81.73 -57.16 3.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.384 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.488 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 44.7 tp60 -80.38 -27.8 38.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.348 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.94 -36.52 3.41 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.595 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 2.0 t80 -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.077 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.434 ' O ' ' N ' ' B' ' 81' ' ' GLY . 5.5 mt -50.17 -34.53 22.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.488 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.86 -38.58 53.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.536 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' B' ' 76' ' ' PHE . 1.8 mp -63.77 -58.24 7.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.713 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.526 ' HA ' ' HG ' ' B' ' 83' ' ' LEU . 0.0 OUTLIER -72.66 -42.33 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.15 178.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.68 -50.04 50.83 Favored Glycine 0 CA--C 1.507 -0.461 0 N-CA-C 109.989 -1.245 . . . . 0.0 109.989 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.479 ' O ' HG22 ' B' ' 85' ' ' VAL . . . -51.38 -40.39 45.95 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.403 -0.903 . . . . 0.0 111.446 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.526 ' HG ' ' HA ' ' B' ' 80' ' ' ILE . 6.1 mt -60.17 -45.63 92.45 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.332 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.443 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.36 -30.8 61.01 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.281 0.562 . . . . 0.0 110.891 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.584 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.04 -17.34 9.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.227 -179.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.35 12.79 17.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.194 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.16 -37.24 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.459 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.474 ' CG ' HD13 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -89.3 -171.07 3.1 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.838 0.351 . . . . 0.0 111.356 -179.727 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.57 55.16 3.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.447 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' SER . . . . . 0.454 ' HB3' HG11 ' B' ' 85' ' ' VAL . 0.6 OUTLIER -117.6 -47.59 2.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.406 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . 0.492 ' O ' HG22 ' B' ' 92' ' ' VAL . 0.7 OUTLIER -135.43 -81.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.412 179.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.492 HG22 ' O ' ' B' ' 91' ' ' PHE . 7.2 m . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 121.389 0.614 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.8 -49.23 10.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.442 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.473 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 3.9 m -64.12 -32.44 74.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.482 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.453 ' HA ' HD12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -52.13 -40.65 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.34 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' O ' ' OG ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -74.79 -26.86 60.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.372 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.7 m -68.14 -53.9 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.511 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.506 HG12 ' CD1' ' B' ' 80' ' ' ILE . 1.8 mp -50.77 -56.36 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.837 0.351 . . . . 0.0 111.355 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.4 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -53.88 -27.78 32.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.886 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -61.8 -55.61 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.268 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.826 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.75 55.93 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.81 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.3 mt -49.79 -29.29 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.103 0.478 . . . . 0.0 112.18 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.3 -31.75 21.43 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.842 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.826 HG21 ' O ' ' A' ' 13' ' ' LEU . 15.6 m -53.32 -33.71 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CD1' ' HB2' ' A' ' 76' ' ' PHE . 1.1 m-85 -80.8 -56.44 4.13 Favored 'General case' 0 N--CA 1.46 0.06 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.79 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.81 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 8.6 mm-40 -48.54 -26.05 2.0 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.461 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.71 69.12 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.556 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 0.1 OUTLIER -80.37 -50.4 10.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.947 0.879 . . . . 0.0 109.805 178.533 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.584 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -61.58 -52.14 65.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.929 -1.487 . . . . 0.0 112.167 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.457 179.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.785 0.326 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 8.5 p -149.22 -177.58 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.975 0.417 . . . . 0.0 111.15 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.584 ' HG ' ' CA ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -141.55 -124.95 0.1 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.117 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.406 ' CB ' ' HB2' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -171.44 128.48 0.68 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.428 ' HA ' HD21 ' A' ' 71' ' ' LEU . 19.6 mtmm -49.64 -41.17 41.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.858 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.65 -41.68 59.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.164 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.406 ' HB2' ' CB ' ' A' ' 31' ' ' SER . 1.6 mt-10 -55.74 -28.84 57.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -26.91 59.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.236 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -61.19 -59.15 5.77 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.488 0.661 . . . . 0.0 111.672 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.8 p -64.6 -51.16 64.15 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.611 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.556 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.7 m-85 -58.05 -50.88 71.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.979 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.3 ttm -58.62 -26.98 64.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -73.25 -19.46 61.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.73 -79.96 0.59 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.511 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.66 -46.22 63.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.234 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.417 ' CD2' HG22 ' B' ' 6' ' ' THR . 6.4 mt -111.21 38.46 2.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.0 110.318 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.1 -30.32 58.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.774 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.28 -25.15 13.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.987 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.43 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.5 m-85 -109.39 23.65 14.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.011 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-O 120.87 0.367 . . . . 0.0 110.972 -179.964 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.7 t . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.694 0.283 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.431 ' CD2' ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -67.37 -52.29 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.163 0.506 . . . . 0.0 110.663 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.431 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 3.8 t0 -59.07 -26.8 64.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.678 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.85 -43.26 93.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.05 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.79 ' HG2' ' N ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -60.87 -53.29 59.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.892 0.377 . . . . 0.0 111.522 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.79 ' N ' ' HG2' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.031 -177.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.594 ' HA ' HE21 ' A' ' 70' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.575 0.226 . . . . 0.0 111.021 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HB3' ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -61.32 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 9.4 t70 166.72 159.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.941 0.791 . . . . 0.0 111.226 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.588 ' HB2' HG13 ' B' ' 85' ' ' VAL . 27.8 p90 -50.22 -58.65 5.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.519 -0.764 . . . . 0.0 113.004 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.5 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 37.0 tp60 -76.94 -29.29 55.57 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.278 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.557 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.97 -49.19 11.32 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.607 ' HB2' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.95 -54.91 23.12 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.621 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.475 ' HG ' ' CZ ' ' A' ' 17' ' ' PHE . 5.7 mt -53.88 -33.98 58.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.2 0.524 . . . . 0.0 110.019 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.15 -31.67 58.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.918 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.591 HD23 ' N ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -70.36 -57.95 4.28 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.896 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.598 HG23 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.17 -42.8 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 CA-C-O 120.721 0.296 . . . . 0.0 110.434 178.424 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.74 -50.7 48.51 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.204 -0.998 . . . . 0.0 110.736 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -52.66 -36.7 49.28 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.768 178.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 7.1 mt -63.64 -45.79 88.59 Favored 'General case' 0 CA--C 1.518 -0.27 0 O-C-N 122.692 -0.299 . . . . 0.0 110.452 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 88' ' ' HIS . . . -54.97 -32.02 61.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.32 0.581 . . . . 0.0 110.413 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.576 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.45 -17.58 9.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.347 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.84 13.66 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.379 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.43 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 1.7 t -154.4 -42.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 -179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.43 ' HB3' ' O ' ' A' ' 84' ' ' ALA . 39.6 t60 -87.67 150.19 23.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.927 0.394 . . . . 0.0 110.712 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.69 110.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.215 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 m -178.94 -62.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.837 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.422 ' HB2' HG11 ' A' ' 85' ' ' VAL . 1.7 m-85 -115.11 -32.85 5.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.157 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.593 -179.52 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.44 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.436 0.636 . . . . 0.0 110.974 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.79 -49.22 10.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.395 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.477 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 4.0 m -64.14 -32.51 74.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.414 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.447 ' HA ' ' CD1' ' B' ' 10' ' ' ILE . 0.0 OUTLIER -52.13 -40.57 61.53 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' B' ' 12' ' ' SER . 0.0 OUTLIER -74.78 -26.84 60.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.44 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . . . . . . . . . 73.7 m -68.17 -53.9 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.508 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.5 HG12 ' CD1' ' A' ' 80' ' ' ILE . 1.8 mp -50.71 -56.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.889 0.376 . . . . 0.0 111.339 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.405 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.9 OUTLIER -53.91 -27.73 32.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.864 -179.338 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.439 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.9 OUTLIER -61.9 -55.59 28.12 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.823 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.77 55.86 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.814 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.2 mt -49.65 -29.4 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 CA-C-O 121.09 0.471 . . . . 0.0 112.162 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.2 -31.86 21.52 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.827 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.823 HG21 ' O ' ' B' ' 13' ' ' LEU . 15.6 m -53.23 -33.86 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 177.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.607 ' CD1' ' HB2' ' B' ' 76' ' ' PHE . 1.1 m-85 -80.74 -56.48 4.11 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.809 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.814 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 8.7 mm-40 -48.49 -26.12 2.0 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.442 -179.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -50.72 69.21 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.555 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 0.1 OUTLIER -80.35 -50.38 10.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.919 0.866 . . . . 0.0 109.859 178.481 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.581 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -61.6 -52.11 65.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.888 -1.506 . . . . 0.0 112.173 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.44 179.977 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 29.9 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.737 0.303 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.41 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 8.1 p -149.2 -177.59 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.958 0.409 . . . . 0.0 111.119 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.581 ' HG ' ' CA ' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -141.49 -124.96 0.1 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.129 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.412 ' CB ' ' HB2' ' B' ' 34' ' ' GLU . 0.1 OUTLIER -171.45 128.6 0.68 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.436 ' HA ' HD21 ' B' ' 71' ' ' LEU . 19.6 mtmm -49.68 -41.18 42.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.622 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.64 -41.73 59.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.153 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.412 ' HB2' ' CB ' ' B' ' 31' ' ' SER . 1.6 mt-10 -55.75 -28.8 57.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 0.0 110.376 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.36 -26.82 58.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.171 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.622 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.2 mm? -61.22 -59.16 5.75 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.568 0.699 . . . . 0.0 111.717 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 46.6 p -64.49 -51.15 64.43 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.694 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.555 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.8 m-85 -58.09 -50.87 71.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.99 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' MET . . . . . . . . . . . . . 3.3 ttm -58.64 -27.06 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 110.5 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 13.6 m-20 -73.16 -19.39 61.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.77 -79.92 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.567 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.62 -46.33 63.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.13 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.422 ' CD2' HG22 ' A' ' 6' ' ' THR . 6.4 mt -111.2 38.49 2.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.272 0.558 . . . . 0.0 110.292 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.11 -30.27 58.18 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.826 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.29 -25.19 13.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.427 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.5 m-85 -109.44 23.76 14.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.006 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.913 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 94.3 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.711 0.291 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.429 ' CD2' ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -67.35 -52.31 41.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.126 0.489 . . . . 0.0 110.654 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . 0.429 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 3.8 t0 -59.01 -26.95 64.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.667 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.7 -43.23 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.051 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.778 ' HG2' ' N ' ' B' ' 60' ' ' MET . 0.0 OUTLIER -60.94 -53.35 58.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 111.455 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.778 ' N ' ' HG2' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.017 -177.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.591 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.54 0.21 . . . . 0.0 111.039 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.548 ' HB3' ' HE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -61.28 -129.62 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 9.4 t70 166.76 159.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.576 ' HB2' HG13 ' A' ' 85' ' ' VAL . 27.5 p90 -50.2 -58.71 5.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.951 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.49 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 36.9 tp60 -76.95 -29.22 55.5 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.326 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.559 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.92 -49.2 11.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.607 ' HB2' ' CD1' ' B' ' 17' ' ' PHE . 0.1 OUTLIER -65.01 -54.85 23.86 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.616 179.281 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.48 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 5.6 mt -53.88 -34.0 58.15 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 110.031 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.423 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.06 -31.71 58.94 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 177.84 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.591 ' N ' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -70.3 -57.92 4.33 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.977 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.601 HG23 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -73.18 -42.83 58.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 120.713 0.292 . . . . 0.0 110.38 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.63 49.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.167 -1.016 . . . . 0.0 110.758 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.432 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -52.73 -36.63 49.68 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.719 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 7.1 mt -63.64 -45.9 88.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 O-C-N 122.698 -0.295 . . . . 0.0 110.449 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.437 ' O ' ' HB3' ' B' ' 88' ' ' HIS . . . -54.97 -32.0 61.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.295 0.569 . . . . 0.0 110.429 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.588 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.63 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.443 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.81 13.67 17.24 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.307 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.433 ' N ' ' O ' ' B' ' 83' ' ' LEU . 1.7 t -154.4 -42.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.437 ' HB3' ' O ' ' B' ' 84' ' ' ALA . 39.5 t60 -87.67 150.08 23.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.822 0.344 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.65 110.61 0.53 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.23 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.3 m -178.94 -62.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . 0.422 ' HB2' HG11 ' B' ' 85' ' ' VAL . 1.7 m-85 -115.15 -32.8 5.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.057 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.501 -179.427 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.48 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.394 0.616 . . . . 0.0 111.23 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.49 -42.0 6.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.43 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.494 ' O ' ' SG ' ' A' ' 9' ' ' CYS . 0.5 OUTLIER -72.17 -41.74 66.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 109.998 179.188 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.48 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 4.5 mm-40 -51.97 -45.85 64.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.984 0.421 . . . . 0.0 109.92 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -73.58 -26.62 60.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.584 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -64.55 -41.15 96.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.527 -179.507 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.586 ' O ' HG13 ' A' ' 14' ' ' ILE . 3.4 mp -73.8 -51.31 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.492 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -51.83 -27.29 12.03 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.641 0.238 . . . . 0.0 111.641 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.517 ' HB3' ' HB2' ' B' ' 9' ' ' CYS . 1.4 t -76.67 -55.73 5.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.653 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.816 ' O ' HG23 ' A' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.48 65.16 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.596 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 20.1 mt -69.96 -41.53 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.865 0 CA-C-O 121.766 0.793 . . . . 0.0 110.741 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.59 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -73.99 -37.82 64.31 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.512 -175.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 13' ' ' LEU . 21.1 m -52.51 -36.99 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 121.731 0.777 . . . . 0.0 109.072 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.633 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 2.9 t80 -80.52 -57.06 3.76 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 114.418 -1.265 . . . . 0.0 113.221 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.718 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -70.55 -24.48 62.8 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -52.16 64.19 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.415 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.513 ' CE1' ' CD2' ' A' ' 38' ' ' PHE . 4.6 m-85 -80.51 -38.45 29.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.763 0.792 . . . . 0.0 109.473 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.718 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.16 -26.62 64.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.746 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.426 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.519 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.879 0.371 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -155.33 -178.34 7.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.468 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -136.82 -123.86 0.14 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.101 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.432 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 5.3 t -175.68 130.33 0.26 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.435 ' CB ' ' HE3' ' A' ' 60' ' ' MET . 0.4 OUTLIER -49.65 -41.41 42.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.011 0.434 . . . . 0.0 110.474 -179.788 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 0.9 OUTLIER -61.95 -50.35 72.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.313 179.317 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.432 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -57.8 -37.13 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -73.4 -31.03 63.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.272 178.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.76 -59.36 5.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.454 0.645 . . . . 0.0 110.217 179.112 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.18 -26.94 68.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.672 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.513 ' CD2' ' CE1' ' A' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.59 85.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.746 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.456 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 1.1 mtp -69.11 -35.23 76.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.133 0.492 . . . . 0.0 110.354 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.5 -19.24 60.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.879 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -110.38 -37.27 5.56 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -128.16 -27.01 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.456 ' CB ' ' HA ' ' A' ' 39' ' ' MET . 5.1 mt -112.07 44.29 1.43 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.526 0.679 . . . . 0.0 109.718 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -78.68 -25.63 44.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.906 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.38 -23.41 65.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.444 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -86.11 -32.33 21.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.542 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.9 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.177 -179.747 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.421 ' CG1' ' HB3' ' A' ' 86' ' ' ALA . 68.0 t . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 121.027 0.442 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.01 -51.69 10.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.099 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.85 -35.76 75.42 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.77 -52.3 66.3 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.52 ' HE2' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -75.34 -54.17 7.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.435 ' HE3' ' CB ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.641 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 . . . . . 0 C--O 1.231 0.117 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.468 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -62.42 -133.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.45 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 4.6 t0 177.19 -178.95 0.19 Allowed 'General case' 0 N--CA 1.461 0.1 0 O-C-N 121.811 -0.556 . . . . 0.0 110.985 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.538 ' CD2' HG21 ' B' ' 85' ' ' VAL . 44.1 p90 -69.22 -55.89 9.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.328 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.566 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -80.5 -26.3 38.26 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.74 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -44.62 -35.94 2.83 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.274 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' ILE . 2.1 t80 -77.87 -54.01 6.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.638 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.85 -33.4 68.61 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.566 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.04 -49.23 18.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 1.041 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 5.6 mp -65.62 -61.5 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.863 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.545 ' N ' ' O ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -57.86 -44.58 86.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.574 178.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.403 ' N ' ' CG2' ' A' ' 80' ' ' ILE . . . -60.77 -50.24 69.7 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 178.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.406 ' HA2' ' CG2' ' A' ' 85' ' ' VAL . . . -58.86 -39.77 94.34 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.053 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 1.041 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.8 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' HIS . . . -58.79 -41.45 86.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.544 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.562 ' HA ' ' HB2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -74.22 -17.29 16.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.321 -179.139 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.421 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . . . -109.34 17.59 21.33 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.329 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.44 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.586 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.497 ' N ' ' O ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.71 2.53 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.465 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -178.86 -168.84 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 111.248 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.11 -27.39 57.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.661 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -53.96 52.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.757 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.248 -179.874 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.475 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.282 0 CA-C-O 121.43 0.633 . . . . 0.0 111.223 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.44 -42.03 6.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.339 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.493 ' O ' ' SG ' ' B' ' 9' ' ' CYS . 0.5 OUTLIER -72.1 -41.85 66.81 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.002 0.429 . . . . 0.0 109.989 179.197 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.475 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 4.5 mm-40 -51.86 -45.82 64.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.021 0.439 . . . . 0.0 109.931 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -73.59 -26.67 60.92 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.611 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -64.58 -41.03 96.54 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.597 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.6 ' O ' HG13 ' B' ' 14' ' ' ILE . 3.4 mp -73.92 -51.32 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.839 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.494 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -51.88 -27.17 11.91 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.526 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 1.4 t -76.78 -55.75 5.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.523 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.809 ' O ' HG23 ' B' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.44 65.13 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.6 HG13 ' O ' ' B' ' 10' ' ' ILE . 20.2 mt -69.94 -41.48 79.49 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.876 0 CA-C-O 121.878 0.847 . . . . 0.0 110.838 178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . 0.598 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -74.05 -37.82 64.16 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 113.513 -1.676 . . . . 0.0 112.523 -175.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.809 HG23 ' O ' ' B' ' 13' ' ' LEU . 21.0 m -52.44 -36.97 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-O 121.718 0.77 . . . . 0.0 109.092 177.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.624 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 2.9 t80 -80.44 -57.24 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.462 -1.245 . . . . 0.0 113.232 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.715 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.8 OUTLIER -70.46 -24.49 62.89 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -177.456 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.17 64.2 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.378 -179.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.503 ' CE1' ' CD2' ' B' ' 38' ' ' PHE . 4.6 m-85 -80.53 -38.44 29.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.796 0.808 . . . . 0.0 109.421 177.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.715 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.23 -26.57 65.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.746 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.565 -179.915 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.925 0.393 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.0 p -155.32 -178.37 7.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.473 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.0 OUTLIER -136.78 -123.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.151 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.434 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 5.3 t -175.66 130.28 0.26 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.675 0.274 . . . . 0.0 110.281 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.427 ' CB ' ' HE3' ' B' ' 60' ' ' MET . 0.4 OUTLIER -49.6 -41.32 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 0.0 110.503 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.469 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 0.9 OUTLIER -62.07 -50.32 72.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.293 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 0.5 OUTLIER -57.85 -37.07 73.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.279 0.561 . . . . 0.0 109.6 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -73.38 -31.07 63.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.274 178.234 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.1 OUTLIER -58.79 -59.32 5.61 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.463 0.649 . . . . 0.0 110.226 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -26.9 68.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.659 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.503 ' CD2' ' CE1' ' B' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.53 85.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.748 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.447 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 1.1 mtp -69.2 -35.09 75.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.09 0.471 . . . . 0.0 110.369 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.56 -19.22 60.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.9 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.401 HG22 ' O ' ' B' ' 38' ' ' PHE . 6.3 t -110.46 -37.19 5.56 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -128.21 -27.05 2.75 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.447 ' CB ' ' HA ' ' B' ' 39' ' ' MET . 5.1 mt -111.97 44.2 1.44 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.415 0.626 . . . . 0.0 109.707 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -78.58 -25.68 45.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.948 -179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.34 -23.43 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -86.05 -32.38 21.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.8 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.182 -179.807 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . 0.422 ' CG1' ' HB3' ' B' ' 86' ' ' ALA . 67.3 t . . . . . 0 N--CA 1.455 -0.204 0 CA-C-O 120.976 0.417 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 5.5 tp -76.94 -51.84 10.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.093 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.74 -35.79 75.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.673 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.77 -52.36 66.04 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.513 ' HE2' ' O ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -75.33 -54.12 7.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.436 ' HE1' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.62 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 . . . . . 0 CA--C 1.528 0.113 0 CA-C-O 120.588 0.232 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.473 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -62.55 -133.86 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.458 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 4.5 t0 177.2 -179.0 0.19 Allowed 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.473 0.579 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.531 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.8 p90 -69.07 -56.01 9.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.384 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -80.45 -26.24 38.46 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.821 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.673 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.66 -35.92 2.85 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.342 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 2.1 t80 -77.8 -54.15 6.67 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.629 178.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.72 -33.58 68.57 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -75.84 -49.34 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 1.041 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 5.6 mp -65.63 -61.43 2.09 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.872 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.495 ' N ' ' O ' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -57.87 -44.54 86.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.585 178.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.405 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -60.78 -50.35 68.58 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.404 ' HA2' ' CG2' ' B' ' 85' ' ' VAL . . . -58.79 -39.68 94.07 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.189 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 1.041 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.81 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' B' ' 88' ' ' HIS . . . -58.78 -41.44 86.66 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.64 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.582 ' HA ' ' HB2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -74.16 -17.39 16.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.404 -179.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . 0.422 ' HB3' ' CG1' ' B' ' 55' ' ' VAL . . . -109.25 17.67 21.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.458 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.45 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.526 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.496 ' N ' ' O ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.74 2.53 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.439 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.582 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 0.0 OUTLIER -178.88 -168.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.322 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.12 -27.33 57.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.649 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -53.89 53.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.269 -179.96 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.231 0 CA-C-O 121.397 0.618 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.9 -47.64 11.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.528 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.502 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 2.6 m -66.79 -34.77 78.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.628 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.59 -39.19 57.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.704 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.11 -26.67 60.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.965 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' CB ' ' B' ' 12' ' ' SER . 76.3 m -69.8 -52.65 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.532 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -58.26 -56.65 14.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.565 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.56 -27.07 15.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.518 -179.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.474 ' O ' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -64.39 -55.88 18.05 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.907 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.903 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.9 mm? -74.25 -27.28 60.68 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.852 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.5 mt -66.73 -35.95 76.05 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 O-C-N 121.73 -0.606 . . . . 0.0 110.824 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.86 61.17 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.25 -176.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.903 HG21 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -53.84 -36.18 29.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.471 0.653 . . . . 0.0 109.74 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.581 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -80.17 -60.04 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.725 -178.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.852 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -66.7 -28.64 68.6 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.11 -50.99 57.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.948 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.484 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -79.67 -31.84 41.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.583 0.706 . . . . 0.0 109.562 178.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.598 ' HB2' ' HA ' ' A' ' 18' ' ' GLN . . . -71.55 -6.99 44.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 114.737 -1.12 . . . . 0.0 112.003 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 C--N 1.331 0.254 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.501 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' A' ' 29' ' ' THR . 3.3 m . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.717 -0.182 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.0 p 54.09 163.22 0.01 OUTLIER 'General case' 0 C--N 1.339 0.143 0 CA-C-O 121.26 0.553 . . . . 0.0 111.637 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.552 HD22 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -114.98 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.13 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.443 ' N ' HD23 ' A' ' 30' ' ' LEU . 14.0 t 175.33 130.03 0.03 OUTLIER 'General case' 0 C--O 1.231 0.113 0 O-C-N 122.21 -0.306 . . . . 0.0 110.387 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.429 ' N ' HD21 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -51.91 -32.38 32.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.987 0.422 . . . . 0.0 110.757 -179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.545 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -68.15 -48.61 64.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.024 179.291 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -28.74 70.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -70.8 -33.36 70.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.6 178.498 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.77 -59.73 4.97 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.502 0.668 . . . . 0.0 111.137 179.881 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.0 m -59.54 -34.02 72.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.06 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CE1' ' CB ' ' A' ' 42' ' ' GLU . 72.8 t80 -60.07 -55.02 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.676 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.46 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -58.57 -28.93 66.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.81 -19.77 60.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.88 -80.95 0.63 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' CB ' ' CE1' ' A' ' 38' ' ' PHE . 2.3 mm-40 -55.59 -24.31 32.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.46 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 11.4 mt -135.04 48.76 2.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.024 0.44 . . . . 0.0 110.838 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.41 -28.15 62.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.325 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.85 -24.75 62.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.636 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -102.26 26.9 7.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 t . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.773 179.838 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.91 0.386 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.448 ' CD2' ' C ' ' A' ' 56' ' ' LEU . 5.5 tt -68.46 -52.62 30.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.433 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -33.4 68.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.212 -178.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -54.18 50.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.251 . . . . 0.0 111.56 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.651 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -76.48 -42.56 43.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.415 ' HG3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.478 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.0 mm-40 . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.745 0.307 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.26 -130.22 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 119.119 -0.467 . . . . 0.0 109.888 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.462 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.5 t0 175.31 -173.98 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.324 0.965 . . . . 0.0 112.375 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.574 ' CD2' HG21 ' B' ' 85' ' ' VAL . 43.5 p90 -83.2 -57.16 3.38 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.071 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.466 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.76 48.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.422 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.694 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.61 -48.27 10.41 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.521 ' CB ' ' HB2' ' A' ' 17' ' ' PHE . 1.7 t80 -65.21 -52.95 51.49 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.298 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.434 ' O ' ' N ' ' A' ' 81' ' ' GLY . 6.1 mt -53.2 -38.96 63.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.145 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -36.61 58.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.849 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -61.5 -57.23 12.97 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.841 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.521 HD13 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.21 -44.8 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.802 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -50.7 48.58 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -56.56 -31.26 60.07 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.225 -0.988 . . . . 0.0 111.525 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 16.6 mt -66.54 -44.77 81.49 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.471 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.73 -33.86 64.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.272 0.558 . . . . 0.0 110.776 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.573 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.96 9.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.736 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -115.13 14.31 16.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.189 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.63 -40.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.399 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.7 t-160 -93.4 177.99 5.86 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.876 0.37 . . . . 0.0 111.123 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.54 93.55 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.92 111.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 1.1 t80 68.69 -67.06 0.22 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.714 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.1 179.851 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.4 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 121.414 0.626 . . . . 0.0 110.855 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -47.6 11.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.606 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.495 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 2.6 m -66.72 -34.79 78.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.678 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.421 ' HA ' HD11 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -51.56 -39.23 57.4 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.69 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.03 -26.74 60.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.983 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.415 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 78.5 m -69.87 -52.59 23.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.175 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.524 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -58.27 -56.68 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.764 0.316 . . . . 0.0 111.414 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.555 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.55 -27.07 15.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.452 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.471 ' O ' HG12 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -64.41 -55.93 17.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.875 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.924 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.9 mm? -74.11 -27.34 60.83 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.854 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.5 mt -66.77 -35.97 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-O 121.387 0.613 . . . . 0.0 110.785 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.8 61.19 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.228 -1.351 . . . . 0.0 112.331 -176.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.924 HG21 ' O ' ' B' ' 13' ' ' LEU . 19.0 m -53.88 -36.12 29.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.467 0.651 . . . . 0.0 109.714 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.598 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 0.8 OUTLIER -80.19 -60.11 2.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.865 -1.062 . . . . 0.0 112.654 -178.668 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.854 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.2 OUTLIER -66.74 -28.58 68.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.293 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.06 -50.93 57.72 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.482 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -79.74 -31.81 41.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 109.606 177.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' B' ' 17' ' ' PHE . . . -71.52 -6.98 44.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.009 -179.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.545 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' B' ' 29' ' ' THR . 3.4 m . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.472 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.0 p 53.93 163.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.126 0 CA-C-O 121.228 0.537 . . . . 0.0 111.676 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -115.04 0.31 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.108 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.449 ' N ' HD23 ' B' ' 30' ' ' LEU . 13.8 t 175.43 130.17 0.04 OUTLIER 'General case' 0 C--O 1.231 0.126 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.43 ' N ' HD21 ' B' ' 71' ' ' LEU . 0.0 OUTLIER -51.98 -32.33 33.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.762 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.554 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -68.22 -48.58 64.76 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.952 179.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -28.65 70.02 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.522 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -70.84 -33.41 70.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.512 178.504 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.2 OUTLIER -58.74 -59.72 4.96 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.431 0.634 . . . . 0.0 111.109 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -59.52 -34.03 72.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.086 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.448 ' HB2' ' CD2' ' B' ' 20' ' ' TYR . 73.1 t80 -60.09 -55.06 38.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.609 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.448 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.3 OUTLIER -58.61 -28.85 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.86 -19.72 60.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.821 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.95 -81.02 0.63 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.446 ' CB ' ' CE1' ' B' ' 38' ' ' PHE . 2.3 mm-40 -55.56 -24.24 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.496 -178.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.448 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 11.3 mt -135.11 48.79 2.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.794 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -27.99 62.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.367 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.7 62.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.722 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -102.24 26.72 7.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 5.0 t . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.768 179.869 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 94.6 t . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.449 ' C ' ' CD2' ' B' ' 56' ' ' LEU . 5.5 tt -68.59 -52.5 31.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.455 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -33.35 68.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.147 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -54.22 49.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.644 0.259 . . . . 0.0 111.502 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.667 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -76.44 -42.63 43.35 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.402 ' HG3' HD12 ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.472 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.0 mm-40 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.715 0.293 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.435 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -65.2 -130.26 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.45 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 1.5 t0 175.28 -174.06 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.232 0.924 . . . . 0.0 112.256 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.573 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.3 p90 -83.19 -57.07 3.43 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.095 -179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.456 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.8 48.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.444 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.688 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.63 -48.14 10.46 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.522 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 1.7 t80 -65.32 -52.86 51.21 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.32 178.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 81' ' ' GLY . 6.1 mt -53.3 -38.93 63.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.964 0.411 . . . . 0.0 110.147 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -36.81 58.27 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.849 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -61.27 -57.35 12.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.891 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.505 HD13 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.1 -44.92 30.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 123.639 0.587 . . . . 0.0 110.76 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' HG21 ' B' ' 80' ' ' ILE . . . -52.66 -50.77 47.7 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -56.66 -31.17 60.26 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 120.197 -1.002 . . . . 0.0 111.505 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 16.8 mt -66.63 -44.73 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.466 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.65 -33.94 64.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.237 0.541 . . . . 0.0 110.787 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.574 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.95 9.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.793 -179.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -115.14 14.47 17.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.226 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.64 -40.5 0.05 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.443 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.466 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.8 t-160 -93.44 178.0 5.85 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 120.94 0.4 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.71 93.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.273 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.93 111.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.606 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.1 t80 68.67 -67.02 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.823 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.131 179.791 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.433 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.338 0.589 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.03 10.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.101 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.499 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.52 -41.59 92.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.07 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.433 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.13 -35.72 36.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.498 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.67 -27.13 40.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.75 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 6' ' ' THR . 2.5 p -70.45 -41.37 72.93 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.296 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.628 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.9 mp -69.3 -54.95 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.731 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.534 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -51.84 -27.22 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.491 ' O ' HG12 ' A' ' 16' ' ' VAL . 6.1 m -75.25 -55.83 5.32 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.84 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.815 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.9 mm? -61.13 -27.34 68.32 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.857 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 9.3 mt -71.8 -37.4 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 CA-C-O 121.505 0.669 . . . . 0.0 110.332 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.54 64.03 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.875 -177.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.815 HG23 ' O ' ' A' ' 13' ' ' LEU . 19.4 m -53.8 -35.7 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.48 0.657 . . . . 0.0 109.479 178.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.583 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -80.33 -59.74 2.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.582 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.857 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.6 OUTLIER -69.91 -24.97 63.47 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -51.71 57.92 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.244 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.473 ' HB3' HD23 ' A' ' 30' ' ' LEU . 1.9 m-85 -80.19 -40.22 27.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.712 0.768 . . . . 0.0 109.41 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.696 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.85 -26.16 57.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.707 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.712 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 p . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.812 0.339 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.506 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 1.1 p -129.98 -176.87 4.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.753 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.477 HD22 ' N ' ' A' ' 31' ' ' SER . 0.0 OUTLIER -137.81 -122.96 0.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.524 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.477 ' N ' HD22 ' A' ' 30' ' ' LEU . 18.5 t -179.82 127.9 0.09 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.409 ' N ' HD23 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -49.77 -40.69 42.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.18 -179.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 5.0 t -61.86 -43.51 98.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.45 ' HB2' HD22 ' A' ' 30' ' ' LEU . 15.7 mt-10 -61.52 -35.75 78.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -74.2 -29.9 61.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 176.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.574 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.84 -59.36 5.35 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.873 178.914 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -63.55 -41.19 98.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.489 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.435 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 t80 -60.02 -45.22 93.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.406 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.416 ' CE ' ' CD1' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -62.46 -31.28 71.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.788 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -73.52 -19.74 60.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.39 -79.34 0.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.091 0.472 . . . . 0.0 111.862 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 2.7 mt-10 -52.07 -29.04 19.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.224 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 52.6 mt -130.41 50.14 2.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.099 0.476 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.2 -28.45 42.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.779 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.63 67.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.137 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -102.06 27.2 6.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.962 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 65.0 p . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.202 -179.935 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.0 t . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' A' ' 59' ' ' MET . 7.7 tp -67.67 -51.16 53.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.96 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.84 -27.0 49.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -50.52 71.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.053 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.685 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 2.4 ptp -57.07 -53.52 57.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.277 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.503 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.364 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.578 ' HA ' HE21 ' A' ' 70' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.779 0.323 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.474 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -65.29 -131.38 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.932 179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.45 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 0.3 OUTLIER 172.69 -168.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.879 0.763 . . . . 0.0 111.364 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.649 ' HB2' HG13 ' B' ' 85' ' ' VAL . 39.8 p90 -80.84 -60.51 2.28 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.894 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.464 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -80.1 -22.19 42.46 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.225 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -47.17 -32.66 4.55 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.521 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 2.3 t80 -80.51 -54.31 5.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.722 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.415 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 5.8 mt -53.75 -33.97 57.48 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.427 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.43 -40.71 49.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 177.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.685 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.7 mp -62.39 -57.64 10.55 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.03 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.518 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -75.21 -45.27 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.121 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.44 -48.87 53.87 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.441 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.47 -41.44 48.84 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.255 -0.974 . . . . 0.0 111.318 178.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.61 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 9.1 mt -56.72 -47.65 79.49 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 110.661 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.62 -32.61 63.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.184 0.516 . . . . 0.0 111.27 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.652 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.27 -17.57 9.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.607 -179.411 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.5 2.21 16.22 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.368 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.492 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -137.6 -41.48 0.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 -179.934 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.5 ' CG ' HD11 ' B' ' 14' ' ' ILE . 0.7 OUTLIER -82.09 -166.64 1.29 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.887 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.87 36.4 1.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.312 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.53 7.56 45.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.461 ' HB2' HG11 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 177.92 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.386 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.1 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.857 179.897 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.443 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.246 0.546 . . . . 0.0 111.242 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.06 10.61 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.074 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.496 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.44 -41.62 93.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.192 0.52 . . . . 0.0 110.108 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.443 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.14 -35.71 37.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.539 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -27.25 41.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.803 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' B' ' 6' ' ' THR . 2.5 p -70.33 -41.42 73.24 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.322 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.628 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.9 mp -69.32 -54.99 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.707 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.548 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -51.75 -27.29 11.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.336 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.488 ' O ' HG12 ' B' ' 16' ' ' VAL . 6.2 m -75.25 -55.92 5.23 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.764 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.807 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.9 mm? -61.03 -27.29 68.22 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.85 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 9.3 mt -71.86 -37.42 61.63 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 121.478 0.656 . . . . 0.0 110.336 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 -39.57 64.12 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.917 -177.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 13' ' ' LEU . 19.4 m -53.76 -35.7 27.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.487 0.661 . . . . 0.0 109.479 178.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.576 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 0.6 OUTLIER -80.28 -59.78 2.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.617 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.85 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.6 OUTLIER -69.92 -24.92 63.45 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -178.179 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -51.79 57.14 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.258 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.486 ' HB3' HD23 ' B' ' 30' ' ' LEU . 1.9 m-85 -80.2 -40.1 27.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.68 0.752 . . . . 0.0 109.413 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.692 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -57.01 -26.09 59.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.675 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.718 -179.753 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.749 0.309 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 1.1 p -130.05 -176.86 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.486 HD23 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -137.8 -122.92 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.539 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.472 ' N ' HD22 ' B' ' 30' ' ' LEU . 18.8 t -179.88 127.84 0.08 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.418 ' N ' HD23 ' B' ' 71' ' ' LEU . 0.0 OUTLIER -49.58 -40.68 39.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.239 -179.149 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.569 ' HA ' ' CD1' ' B' ' 36' ' ' LEU . 5.0 t -61.99 -43.44 98.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.455 ' HB2' HD22 ' B' ' 30' ' ' LEU . 15.7 mt-10 -61.5 -35.65 78.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.515 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -74.32 -29.85 61.79 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 176.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.569 ' CD1' ' HA ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -57.81 -59.39 5.3 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.874 178.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.9 p -63.6 -41.16 98.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.411 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.435 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 9.0 t80 -60.08 -45.19 93.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.429 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.415 ' CE ' ' CD1' ' B' ' 83' ' ' LEU . 0.0 OUTLIER -62.39 -31.39 72.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.824 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.4 -19.72 60.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.242 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.45 -79.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.102 0.477 . . . . 0.0 111.777 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.435 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.7 mt-10 -52.02 -29.04 19.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.224 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.33 50.09 2.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.039 0.447 . . . . 0.0 110.811 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.22 -28.41 42.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.856 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.01 -24.71 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.072 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -102.08 27.26 6.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.96 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 65.4 p . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.177 -179.918 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 39.0 t . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 121.019 0.438 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -67.74 -51.09 53.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.997 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -55.83 -26.96 49.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.32 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -50.42 72.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.008 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.678 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 2.4 ptp -57.13 -53.48 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.293 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.506 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.399 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.572 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.913 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.479 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.3 OUTLIER -65.35 -131.4 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.931 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.446 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.2 OUTLIER 172.68 -168.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.939 0.791 . . . . 0.0 111.392 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.652 ' HB2' HG13 ' A' ' 85' ' ' VAL . 39.9 p90 -80.92 -60.6 2.24 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.761 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -80.03 -22.25 42.6 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.21 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -47.19 -32.66 4.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.515 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 2.2 t80 -80.48 -54.28 5.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.765 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' B' ' 81' ' ' GLY . 5.8 mt -53.79 -33.88 57.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.417 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -40.73 49.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.678 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.7 mp -62.24 -57.67 10.59 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.07 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.517 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -75.24 -45.32 41.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.073 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.416 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -52.5 -48.86 54.28 Favored Glycine 0 C--N 1.333 0.4 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.441 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.43 -41.36 48.38 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.359 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.617 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 9.2 mt -56.93 -47.55 80.37 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 120.676 0.274 . . . . 0.0 110.623 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.47 -32.81 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.199 0.523 . . . . 0.0 111.254 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.649 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.51 9.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.592 -179.332 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.48 2.17 16.22 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.418 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -137.59 -41.49 0.55 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.497 ' CG ' HD11 ' A' ' 14' ' ' ILE . 0.7 OUTLIER -82.06 -166.65 1.29 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.815 0.34 . . . . 0.0 110.919 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.76 36.35 1.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.346 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.56 7.53 45.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.051 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . 0.46 ' HB2' HG11 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 177.88 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 t . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.799 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.434 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 121.544 0.688 . . . . 0.0 111.152 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.36 -48.98 13.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.417 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.504 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 2.3 m -64.34 -37.1 86.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.53 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.434 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.75 -38.25 54.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.727 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.87 -26.77 43.99 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.092 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.426 ' HA ' ' CB ' ' B' ' 12' ' ' SER . 63.9 m -69.23 -52.99 22.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.553 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -53.25 -56.15 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.541 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.495 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.44 -27.31 15.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.536 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -68.52 -55.9 10.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.932 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -68.68 -27.69 66.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -178.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.746 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.5 mt -68.1 -36.34 75.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 O-C-N 121.666 -0.646 . . . . 0.0 110.508 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -32.65 41.89 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.482 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.932 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.2 m -51.73 -37.14 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 4.9 t80 -78.37 -58.54 3.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.319 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.746 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.5 mm-40 -49.13 -32.92 10.85 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.23 -51.96 67.59 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.876 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.491 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 2.1 m-85 -81.2 -47.69 13.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.778 0.799 . . . . 0.0 109.963 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 17' ' ' PHE . . . -61.31 -17.03 51.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.887 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.39 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.491 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.3 p . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.519 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -143.38 150.84 39.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.144 0.497 . . . . 0.0 111.455 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.532 HD21 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -107.69 -152.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.961 179.264 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.414 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -148.52 147.62 29.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.207 0.527 . . . . 0.0 111.089 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -44.76 68.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.755 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.849 ' HA ' ' CD2' ' A' ' 36' ' ' LEU . 1.9 m -74.62 -36.4 62.93 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.33 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -55.06 -30.63 60.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.496 ' CE2' ' HB3' ' A' ' 79' ' ' LEU . 2.3 t80 -81.21 -47.55 13.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.272 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.849 ' CD2' ' HA ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -63.46 -28.08 69.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.783 0.325 . . . . 0.0 110.39 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.57 -28.38 33.86 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 20' ' ' TYR . 3.4 t80 -59.06 -54.79 43.09 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.983 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.556 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 2.8 mtp -48.8 -30.11 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.521 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -73.59 -19.47 60.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.186 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -105.11 -50.8 3.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.309 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -128.31 -12.55 5.07 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.556 ' CB ' ' HA ' ' A' ' 39' ' ' MET . 6.4 mt -117.48 46.71 1.66 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.353 0.597 . . . . 0.0 110.296 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.11 -30.54 27.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.993 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.43 -26.02 28.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.823 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -97.23 22.72 8.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.407 ' CG2' ' HB3' ' A' ' 39' ' ' MET . 26.2 p . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.448 ' CG2' ' N ' ' A' ' 56' ' ' LEU . 2.0 m . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 121.169 0.509 . . . . 0.0 110.53 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.448 ' N ' ' CG2' ' A' ' 55' ' ' VAL . 8.7 tp -68.99 -51.48 38.96 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.002 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.16 -28.72 69.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.212 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.61 73.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.821 0.344 . . . . 0.0 110.849 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.613 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 1.8 ptp -67.27 -53.44 29.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.138 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.507 ' N ' ' CG ' ' A' ' 59' ' ' MET . 10.0 mmt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.31 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.537 ' O ' ' O ' ' A' ' 71' ' ' LEU . 2.2 mm-40 . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 120.389 0.138 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.6 ' HG ' ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -54.2 -130.62 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.571 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.596 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 3.8 p30 162.4 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.619 ' HB2' HG11 ' B' ' 85' ' ' VAL . 41.6 p90 -83.39 -58.62 2.75 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.54 ' O ' ' N ' ' A' ' 78' ' ' ASN . 42.0 tp60 -80.33 -34.54 36.56 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.6 ' HB3' ' HG ' ' A' ' 71' ' ' LEU . 2.2 tt0 -44.49 -39.54 4.9 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.285 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 16' ' ' VAL . 3.2 t80 -71.74 -52.86 15.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.469 ' O ' ' N ' ' A' ' 81' ' ' GLY . 5.4 mt -55.62 -33.45 64.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -73.03 -40.3 65.25 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.613 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.8 mp -62.51 -57.13 12.26 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.543 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.559 HG22 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -70.45 -42.74 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 CA-C-O 120.828 0.347 . . . . 0.0 110.507 178.567 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.67 -50.58 48.57 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.413 -0.899 . . . . 0.0 110.895 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.499 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.74 -41.0 49.89 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.352 -0.927 . . . . 0.0 111.721 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.554 ' CD2' ' HE2' ' A' ' 59' ' ' MET . 4.0 mt -60.17 -46.79 88.51 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 122.634 -0.333 . . . . 0.0 110.787 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.13 58.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.093 0.473 . . . . 0.0 111.296 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.62 HG11 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.61 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.114 -178.8 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.406 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -117.66 8.46 12.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.963 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.82 -37.78 0.4 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.663 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.416 ' CG ' HD12 ' B' ' 14' ' ' ILE . 1.6 t60 -103.49 166.68 10.28 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.883 0.373 . . . . 0.0 111.06 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -59.75 115.7 3.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.64 -68.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.681 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -114.67 -32.56 5.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.749 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.472 -179.529 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.428 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.23 0 CA-C-O 121.51 0.671 . . . . 0.0 111.229 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.3 -49.08 12.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.323 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.495 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 2.4 m -64.32 -37.04 86.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.51 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.428 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -38.19 54.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.768 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.91 -26.82 43.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.061 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.42 ' HA ' ' CB ' ' A' ' 12' ' ' SER . 63.9 m -69.21 -52.93 22.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.244 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.547 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -53.19 -56.18 9.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.639 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.481 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.28 -27.52 15.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.757 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.54 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -68.5 -55.86 10.32 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.944 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -68.67 -27.76 66.27 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.758 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.6 mt -68.08 -36.4 75.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 O-C-N 121.724 -0.61 . . . . 0.0 110.446 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.58 -32.56 42.0 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.545 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.944 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.9 m -51.77 -37.12 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 4.8 t80 -78.39 -58.62 3.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.3 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.758 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.5 mm-40 -49.06 -32.94 10.48 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.16 -51.93 67.66 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.959 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.498 ' CD1' ' CD2' ' B' ' 38' ' ' PHE . 2.1 m-85 -81.17 -47.74 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.782 0.801 . . . . 0.0 109.952 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' B' ' 17' ' ' PHE . . . -61.43 -16.92 51.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.926 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.421 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.603 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.878 0.371 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.533 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -143.39 150.83 39.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.211 0.529 . . . . 0.0 111.508 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -107.71 -152.33 0.48 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.91 179.361 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.413 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -148.49 147.51 29.19 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.128 0.489 . . . . 0.0 111.115 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -44.81 68.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.751 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.865 ' HA ' ' CD2' ' B' ' 36' ' ' LEU . 1.9 m -74.61 -36.41 62.95 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.295 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.426 ' HB3' HD23 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.16 -30.59 60.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.5 ' CE2' ' HB3' ' B' ' 79' ' ' LEU . 2.3 t80 -81.28 -47.52 13.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.246 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.865 ' CD2' ' HA ' ' B' ' 33' ' ' THR . 0.6 OUTLIER -63.42 -28.03 69.7 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 120.872 0.367 . . . . 0.0 110.509 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.55 -28.42 33.91 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.222 0.534 . . . . 0.0 109.641 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.498 ' CD2' ' CD1' ' B' ' 20' ' ' TYR . 3.4 t80 -58.95 -54.79 43.17 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.01 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.56 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 2.7 mtp -48.89 -30.17 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -73.55 -19.51 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' B' ' 38' ' ' PHE . 0.7 OUTLIER -105.08 -50.74 3.17 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -178.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -128.42 -12.5 5.01 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.56 ' CB ' ' HA ' ' B' ' 39' ' ' MET . 6.4 mt -117.63 46.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.294 0.568 . . . . 0.0 110.218 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.19 -30.53 27.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.989 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.39 -26.03 27.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -97.28 22.87 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.852 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.407 ' CG2' ' HB3' ' B' ' 39' ' ' MET . 26.6 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.178 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . 0.455 ' CG2' ' N ' ' B' ' 56' ' ' LEU . 2.0 m . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 121.136 0.493 . . . . 0.0 110.489 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.455 ' N ' ' CG2' ' B' ' 55' ' ' VAL . 8.7 tp -69.05 -51.47 38.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.96 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.14 -28.69 69.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -35.57 73.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.63 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 1.8 ptp -67.23 -53.41 30.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.507 ' N ' ' CG ' ' B' ' 59' ' ' MET . 10.0 mmt . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.247 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.533 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.391 0.139 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.6 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.1 OUTLIER -54.3 -130.64 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.593 -179.685 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.6 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 3.7 p30 162.53 -148.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.62 ' HB2' HG11 ' A' ' 85' ' ' VAL . 41.7 p90 -83.38 -58.57 2.77 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.586 ' O ' ' N ' ' B' ' 78' ' ' ASN . 42.1 tp60 -80.31 -34.59 36.65 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.585 ' HB3' ' HG ' ' B' ' 71' ' ' LEU . 2.2 tt0 -44.63 -39.39 4.99 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.296 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.574 ' CE1' HG21 ' B' ' 16' ' ' VAL . 3.2 t80 -71.72 -52.9 15.4 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' B' ' 81' ' ' GLY . 5.4 mt -55.56 -33.51 63.93 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -72.96 -40.35 65.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.63 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.8 mp -62.47 -57.22 12.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.472 179.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.56 HG22 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -70.43 -42.75 78.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.769 0.319 . . . . 0.0 110.497 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.476 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.67 -50.64 48.3 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.498 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.79 -40.95 50.17 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.37 -0.919 . . . . 0.0 111.725 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.555 ' CD2' ' HE2' ' B' ' 59' ' ' MET . 4.0 mt -60.09 -46.87 88.14 Favored 'General case' 0 C--N 1.332 -0.171 0 O-C-N 122.624 -0.339 . . . . 0.0 110.813 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.51 -29.1 58.25 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.089 0.471 . . . . 0.0 111.348 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.619 HG11 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.62 9.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.04 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -117.66 8.45 12.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.978 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.81 -37.81 0.4 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.655 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.415 ' CG ' HD12 ' A' ' 14' ' ' ILE . 1.6 t60 -103.5 166.61 10.32 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.922 0.391 . . . . 0.0 111.052 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.64 115.71 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.69 -68.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.703 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . 0.407 ' HB2' HG12 ' B' ' 85' ' ' VAL . 4.5 t80 -114.58 -32.49 5.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.77 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.505 -179.523 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.359 0.6 . . . . 0.0 111.106 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -44.84 -49.31 10.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.621 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.477 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -62.53 -39.11 92.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.122 0.487 . . . . 0.0 109.894 178.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.522 ' HA ' HD11 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -51.63 -30.25 20.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.293 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -27.91 41.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.777 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.443 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 5.5 p -75.3 -41.79 56.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.261 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.582 ' O ' HG13 ' A' ' 14' ' ' ILE . 1.9 mp -68.26 -53.81 26.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.869 0.366 . . . . 0.0 111.301 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.469 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -51.88 -27.29 12.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.101 -178.651 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.517 ' O ' HG13 ' A' ' 16' ' ' VAL . 9.1 m -73.65 -56.05 5.5 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.873 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.6 mm? -63.43 -28.76 70.19 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.688 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 14.4 mt -68.97 -38.53 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.881 0 CA-C-O 121.593 0.711 . . . . 0.0 110.894 179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.627 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -78.46 -31.38 47.89 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.786 -175.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 13' ' ' LEU . 24.9 m -54.34 -40.77 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -81.71 -55.48 4.61 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -178.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.9 -24.76 67.99 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.733 -177.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -51.38 62.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.492 ' HB3' HD23 ' A' ' 30' ' ' LEU . 9.8 m-85 -81.38 -29.01 34.13 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.815 176.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 17' ' ' PHE . . . -85.88 20.25 2.28 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.121 -178.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.495 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.904 0.383 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.452 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.2 p -154.25 160.99 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.196 0.522 . . . . 0.0 111.158 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.517 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -114.8 -116.73 0.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.009 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.469 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 23.1 t 179.98 130.16 0.09 Allowed 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.411 ' N ' HD23 ' A' ' 71' ' ' LEU . 8.5 ttpt -49.73 -36.34 25.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.919 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.748 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -73.99 -45.25 51.09 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 4.2 mt-10 -55.92 -29.05 59.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.972 0.415 . . . . 0.0 110.276 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.23 -26.96 63.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.913 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.748 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.28 -58.87 5.92 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.663 0.744 . . . . 0.0 110.852 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.44 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 6.3 m -55.52 -44.95 77.15 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.815 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.446 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 50.8 t80 -57.86 -27.21 63.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.044 0.45 . . . . 0.0 110.449 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.442 ' O ' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -74.15 -64.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.69 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -56.61 -19.44 16.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.032 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' A' ' 42' ' ' GLU . 12.2 t -98.52 -26.48 14.41 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.2 OUTLIER -129.9 -41.15 1.32 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.634 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.416 ' CD1' ' CE ' ' A' ' 39' ' ' MET . 14.0 mt -115.31 48.03 1.23 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.267 0.556 . . . . 0.0 110.046 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -84.5 -35.68 22.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.327 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.4 -22.72 8.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.878 0.371 . . . . 0.0 110.925 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 2.3 m-85 -88.98 -29.06 19.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.798 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.849 -179.822 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.463 ' CG2' ' N ' ' A' ' 56' ' ' LEU . 2.0 m . . . . . 0 N--CA 1.463 0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.463 ' N ' ' CG2' ' A' ' 55' ' ' VAL . 0.5 OUTLIER -59.72 -51.46 69.69 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.703 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.81 -26.01 65.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.666 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -33.61 69.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 0.0 110.567 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.822 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -75.11 -54.3 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.648 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.523 ' N ' ' CG ' ' A' ' 59' ' ' MET . 1.9 mtm . . . . . 0 C--N 1.326 -0.441 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.774 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.452 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.75 0.309 . . . . 0.0 111.052 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.704 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -65.8 -133.53 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.704 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 20.7 t70 160.37 165.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 118.895 0.77 . . . . 0.0 111.121 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.57 ' CG ' ' N ' ' A' ' 74' ' ' GLN . 0.7 OUTLIER -46.46 -56.45 5.92 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.265 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.57 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 23.9 tp60 -79.01 -33.25 45.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.521 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -44.79 -31.98 1.39 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.612 ' CG ' ' HB2' ' A' ' 17' ' ' PHE . 1.5 m-85 -80.51 -54.76 5.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.708 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' A' ' 81' ' ' GLY . 7.2 mt -61.69 -33.71 74.48 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.688 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.401 ' ND2' HD11 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -71.87 -36.62 70.15 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.822 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.3 mp -65.74 -57.75 7.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.764 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.608 HG22 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -74.65 -41.99 48.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.493 179.197 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.99 51.52 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.431 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.77 -37.09 42.4 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 111.614 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.576 ' CD2' ' HE1' ' A' ' 59' ' ' MET . 5.4 mt -62.57 -47.49 83.62 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.807 0.337 . . . . 0.0 110.36 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.445 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.61 -30.8 61.53 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.361 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.544 ' CG1' ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.19 -17.34 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.787 -178.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -115.44 7.69 15.08 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.622 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -145.8 -42.79 0.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 12.7 m-70 -85.83 176.44 8.1 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.51 2.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.54 -56.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.823 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.33 -44.49 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.295 -179.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.403 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.185 0 CA-C-O 121.404 0.621 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -44.9 -49.26 11.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.629 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.482 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.4 OUTLIER -62.62 -39.01 92.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.095 0.474 . . . . 0.0 109.889 179.027 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.515 ' HA ' HD11 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -51.74 -30.26 21.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.282 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.54 -27.8 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.8 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.441 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 5.6 p -75.3 -41.84 56.05 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.26 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.581 ' O ' HG13 ' B' ' 14' ' ' ILE . 1.9 mp -68.24 -53.76 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.4 . . . . 0.0 111.354 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.486 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.5 OUTLIER -51.91 -27.27 12.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.075 -178.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.518 ' O ' HG13 ' B' ' 16' ' ' VAL . 8.9 m -73.71 -56.04 5.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.875 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.6 mm? -63.48 -28.67 70.12 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.68 ' O ' ' HG3' ' B' ' 18' ' ' GLN . 14.5 mt -69.04 -38.38 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.884 0 CA-C-O 121.508 0.671 . . . . 0.0 110.881 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . 0.628 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -78.59 -31.34 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.113 -1.403 . . . . 0.0 112.744 -175.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.875 HG23 ' O ' ' B' ' 13' ' ' LEU . 25.0 m -54.38 -40.77 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -81.72 -55.41 4.65 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -178.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' B' ' 14' ' ' ILE . 0.0 OUTLIER -62.86 -24.82 67.99 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.69 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.33 -51.37 62.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.463 ' HB3' HD23 ' B' ' 30' ' ' LEU . 9.7 m-85 -81.38 -28.97 34.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.835 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' B' ' 17' ' ' PHE . . . -85.89 20.29 2.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.116 -178.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.55 179.883 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.946 0.403 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 9.3 p -154.25 160.96 42.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.261 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.504 ' HB2' ' HB1' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -114.84 -116.75 0.32 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.997 179.474 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.47 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 23.1 t -179.99 130.24 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.421 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 8.5 ttpt -49.83 -36.27 26.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.891 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.751 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.08 -45.26 50.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.47 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 4.2 mt-10 -55.9 -28.99 59.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.352 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.19 -27.04 63.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.881 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.751 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.27 -58.92 5.73 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.616 0.722 . . . . 0.0 110.825 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' SER . . . . . 0.435 ' HB2' ' CE2' ' B' ' 20' ' ' TYR . 6.2 m -55.49 -44.86 76.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.878 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.453 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 50.6 t80 -58.01 -27.13 63.25 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.464 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.446 ' O ' ' N ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -74.19 -64.48 1.01 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.762 179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -56.57 -19.66 16.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.983 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 12.1 t -98.4 -26.36 14.5 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.2 OUTLIER -129.92 -41.19 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.414 ' CD1' ' CE ' ' B' ' 39' ' ' MET . 13.9 mt -115.35 48.07 1.23 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -84.58 -35.59 22.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.389 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.67 8.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.949 0.404 . . . . 0.0 111.008 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.437 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 2.4 m-85 -89.01 -29.0 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.782 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . 0.469 ' CG2' ' N ' ' B' ' 56' ' ' LEU . 2.0 m . . . . . 0 N--CA 1.462 0.138 0 CA-C-O 121.045 0.45 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.469 ' N ' ' CG2' ' B' ' 55' ' ' VAL . 0.5 OUTLIER -59.74 -51.38 70.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.755 -179.535 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.88 -26.08 65.83 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.575 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -33.66 69.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.848 0.356 . . . . 0.0 110.607 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.819 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.18 -54.26 7.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.581 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.532 ' N ' ' CG ' ' B' ' 59' ' ' MET . 1.9 mtm . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.444 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.1 mm-40 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.731 0.301 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.706 ' O ' ' HB2' ' B' ' 72' ' ' ASP . 0.1 OUTLIER -65.76 -133.48 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.706 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 20.7 t70 160.36 165.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 118.93 0.786 . . . . 0.0 111.079 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.562 ' CG ' ' N ' ' B' ' 74' ' ' GLN . 0.7 OUTLIER -46.43 -56.4 5.97 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.303 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.562 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 23.6 tp60 -79.07 -33.25 44.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.489 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.485 ' HB2' ' HB3' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -44.8 -31.97 1.4 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.872 0.368 . . . . 0.0 110.317 179.361 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.601 ' CG ' ' HB2' ' B' ' 17' ' ' PHE . 1.5 m-85 -80.49 -54.62 5.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.787 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' B' ' 81' ' ' GLY . 7.2 mt -61.72 -33.76 74.6 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.716 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.401 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -71.86 -36.7 70.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.819 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.3 mp -65.67 -57.7 7.45 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.608 HG22 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -74.74 -41.85 47.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.781 0.324 . . . . 0.0 110.496 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -49.95 52.3 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.423 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.74 -37.08 42.1 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.64 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.569 ' CD2' ' HE1' ' B' ' 59' ' ' MET . 5.4 mt -62.69 -47.43 83.68 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.463 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.62 -30.7 61.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.172 0.511 . . . . 0.0 111.461 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.555 ' CG1' ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.37 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.785 -179.02 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . 0.403 ' CB ' ' HB ' ' B' ' 55' ' ' VAL . . . -115.49 7.71 15.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.533 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.437 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -145.72 -42.78 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.009 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.463 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.8 m-70 -85.9 176.41 8.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.42 2.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -56.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.871 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.37 -44.45 1.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.878 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.414 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 121.394 0.616 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -44.04 9.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.348 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.474 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.5 m -68.67 -38.15 80.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.275 179.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.414 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.2 OUTLIER -52.04 -37.13 52.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.68 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.38 -26.77 41.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.816 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.446 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.8 OUTLIER -68.65 -47.34 66.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.392 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.514 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.1 mp -61.01 -57.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.69 0.281 . . . . 0.0 111.066 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.48 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -53.84 -27.57 30.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.183 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.444 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -62.7 -55.5 26.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.781 -179.54 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.825 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.1 mm? -71.35 -41.76 69.36 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.0 mt -56.11 -29.33 26.97 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 CA-C-O 121.083 0.468 . . . . 0.0 112.128 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.14 -32.89 21.06 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.526 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.825 HG21 ' O ' ' A' ' 13' ' ' LEU . 14.2 m -54.7 -31.4 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 76' ' ' PHE . 1.1 m-85 -80.34 -58.09 3.3 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.335 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.755 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.9 mm-40 -48.5 -30.86 5.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.6 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -61.96 -51.36 68.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.866 0.365 . . . . 0.0 110.505 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -80.42 -32.95 37.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.748 0.785 . . . . 0.0 109.563 178.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.496 ' N ' ' HG ' ' A' ' 30' ' ' LEU . . . -90.4 19.9 4.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.854 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.399 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 p . . . . . 0 CA--C 1.527 0.096 0 CA-C-O 120.685 0.279 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.429 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 37.5 p -140.26 -176.51 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.193 0.521 . . . . 0.0 111.357 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.496 ' HG ' ' N ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -135.38 -129.07 0.15 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.177 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.418 ' CB ' ' HB2' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -173.86 131.06 0.41 Allowed 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.53 -42.58 44.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 0.0 110.619 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.825 ' HA ' ' CD2' ' A' ' 36' ' ' LEU . 1.9 m -75.2 -43.12 53.75 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.192 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.418 ' HB2' ' CB ' ' A' ' 31' ' ' SER . 3.1 mt-10 -55.28 -28.87 56.39 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.403 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.7 19.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.091 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.825 ' CD2' ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.7 62.12 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.089 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' THR . 2.2 t -81.4 -53.81 5.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.272 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.506 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -62.31 -36.02 80.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.296 179.494 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.428 ' HG3' ' CB ' ' A' ' 43' ' ' LEU . 4.2 ttm -46.67 -36.94 7.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.128 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -64.0 -19.33 65.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.186 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.438 ' CG2' ' CG ' ' A' ' 42' ' ' GLU . 4.6 t -84.12 -30.71 25.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.438 ' CG ' ' CG2' ' A' ' 41' ' ' THR . 1.0 OUTLIER -135.35 -38.01 0.76 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.191 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.43 HD23 ' CD1' ' A' ' 46' ' ' PHE . 19.0 mt -104.65 36.09 2.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.39 0.614 . . . . 0.0 110.146 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.24 35.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.11 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.75 -24.23 14.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.821 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.468 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 3.1 m-85 -100.27 27.11 5.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.784 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.5 p . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.059 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 85.6 t . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.661 0.267 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.496 ' HG ' ' CE ' ' A' ' 60' ' ' MET . 0.1 OUTLIER -69.39 -51.61 34.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.298 0.57 . . . . 0.0 110.208 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -54.6 -26.71 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.607 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.99 -53.03 62.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.663 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.796 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 2.5 ptp -60.54 -53.73 53.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.01 0.433 . . . . 0.0 110.456 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.604 ' HE1' ' HG2' ' A' ' 59' ' ' MET . 2.3 mtm . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.757 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.536 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.487 0.184 . . . . 0.0 110.609 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.533 HD11 HD21 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -63.71 -140.45 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.51 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.6 OUTLIER 165.61 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.256 0.55 . . . . 0.0 111.392 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.634 ' HB2' ' CG1' ' B' ' 85' ' ' VAL . 0.8 OUTLIER -46.05 -61.81 1.6 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.585 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.18 -30.43 38.81 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.267 -179.35 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.527 ' HB3' ' CD1' ' A' ' 71' ' ' LEU . 0.4 OUTLIER -46.58 -31.35 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.784 179.397 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.554 ' HB3' ' CD1' ' A' ' 17' ' ' PHE . 0.8 OUTLIER -79.36 -54.38 6.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.771 178.332 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.509 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 6.3 mt -61.07 -34.04 74.28 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.617 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.507 ' HB2' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -72.38 -34.57 68.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.054 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.796 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 0.3 OUTLIER -67.83 -57.83 5.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.685 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.615 HG23 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -74.27 -43.77 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.112 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -53.02 -50.35 51.66 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.42 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.81 -37.32 43.25 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.659 177.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 7.6 mt -64.01 -45.46 88.85 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.737 0.303 . . . . 0.0 110.219 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.438 ' HA ' ' CD2' ' A' ' 88' ' ' HIS . . . -55.25 -32.75 62.58 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.338 0.59 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.627 ' CG1' ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.48 9.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.666 -179.487 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.32 12.08 18.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.299 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.92 -39.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.677 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.468 ' NE2' ' CE2' ' A' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.61 12.26 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.774 0.321 . . . . 0.0 111.19 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.7 89.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.152 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.1 m 176.55 107.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 75.88 -48.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 31.2 m . . . . . 0 C--N 1.332 -0.16 0 CA-C-O 120.885 0.374 . . . . 0.0 111.654 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.415 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 0.0 111.171 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -43.95 9.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.326 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.479 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.5 m -68.77 -38.08 79.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.277 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.2 OUTLIER -52.12 -37.04 52.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.667 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -26.88 42.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.802 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.8 OUTLIER -68.65 -47.39 66.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.397 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.512 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.1 mp -60.96 -56.9 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 120.768 0.318 . . . . 0.0 111.132 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.466 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -54.0 -27.51 32.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.19 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 0.2 OUTLIER -62.67 -55.54 25.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.817 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.819 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.1 mm? -71.37 -41.72 69.36 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.742 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 mt -56.1 -29.3 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 121.913 -0.492 . . . . 0.0 112.136 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.13 -32.84 21.09 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.554 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.819 HG21 ' O ' ' B' ' 13' ' ' LEU . 14.4 m -54.74 -31.4 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.558 ' CD1' ' HB3' ' B' ' 76' ' ' PHE . 1.1 m-85 -80.28 -58.16 3.27 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.373 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.742 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.9 mm-40 -48.56 -30.73 5.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.622 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -62.06 -51.31 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.873 0.368 . . . . 0.0 110.495 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.502 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 0.2 OUTLIER -80.31 -33.05 37.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.804 0.812 . . . . 0.0 109.631 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.502 ' N ' ' HG ' ' B' ' 30' ' ' LEU . . . -90.42 20.04 4.8 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.213 -1.358 . . . . 0.0 111.743 -178.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.406 179.919 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.598 0.237 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 37.5 p -140.22 -176.4 4.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.363 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.502 ' HG ' ' N ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -135.48 -129.14 0.15 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.183 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.416 ' CB ' ' HB2' ' B' ' 34' ' ' GLU . 0.0 OUTLIER -173.82 131.04 0.42 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.49 -42.62 43.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.82 0.343 . . . . 0.0 110.643 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.824 ' HA ' ' CD2' ' B' ' 36' ' ' LEU . 1.9 m -75.18 -43.14 53.87 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.256 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' B' ' 38' ' ' PHE . 3.1 mt-10 -55.13 -28.98 56.62 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.401 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.72 19.44 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.038 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.824 ' CD2' ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.84 62.15 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.987 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' SER . . . . . 0.409 ' N ' ' O ' ' B' ' 33' ' ' THR . 2.1 t -81.31 -53.8 6.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.309 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.502 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -62.44 -35.86 80.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.363 179.553 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.44 ' HG3' ' CB ' ' B' ' 43' ' ' LEU . 4.1 ttm -46.79 -36.87 7.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.005 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -64.01 -19.46 65.2 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.444 ' CG2' ' CG ' ' B' ' 42' ' ' GLU . 4.5 t -83.94 -30.82 25.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.444 ' CG ' ' CG2' ' B' ' 41' ' ' THR . 1.0 OUTLIER -135.4 -37.94 0.76 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -178.118 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.44 ' CB ' ' HG3' ' B' ' 39' ' ' MET . 19.0 mt -104.68 36.07 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.41 0.624 . . . . 0.0 110.184 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.37 -38.23 35.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.14 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.69 -24.32 14.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.805 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.459 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 3.1 m-85 -100.25 27.12 5.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.77 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 82.6 p . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.042 -179.931 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 86.6 t . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.706 0.289 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.492 ' HG ' ' CE ' ' B' ' 60' ' ' MET . 0.1 OUTLIER -69.35 -51.72 34.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 110.175 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -54.5 -26.85 33.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.9 -53.08 62.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.617 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.78 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 2.5 ptp -60.56 -53.8 53.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.373 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.615 ' HE1' ' HG2' ' B' ' 59' ' ' MET . 2.2 mtm . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.75 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.553 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.485 0.183 . . . . 0.0 110.536 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.54 HD11 HD21 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -63.7 -140.45 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.506 ' O ' ' CE2' ' B' ' 76' ' ' PHE . 0.6 OUTLIER 165.66 175.7 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.177 0.513 . . . . 0.0 111.428 178.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.627 ' HB2' ' CG1' ' A' ' 85' ' ' VAL . 0.9 OUTLIER -46.04 -61.8 1.6 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -177.639 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.582 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.29 -30.42 38.28 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.211 -179.266 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.507 ' HB3' ' CD1' ' B' ' 71' ' ' LEU . 0.4 OUTLIER -46.45 -31.49 2.72 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.873 179.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' B' ' 17' ' ' PHE . 0.8 OUTLIER -79.18 -54.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 120.462 -0.495 . . . . 0.0 109.818 178.242 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.519 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 6.3 mt -60.96 -34.02 74.11 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.716 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.509 ' HB2' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -72.44 -34.55 67.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.043 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.78 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 0.3 OUTLIER -67.86 -57.82 5.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.645 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.597 HG23 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -74.23 -43.77 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.135 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.1 -50.34 52.0 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.426 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.86 -37.34 43.67 Favored Glycine 0 CA--C 1.52 0.405 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.633 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 7.7 mt -64.02 -45.34 89.34 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.773 0.321 . . . . 0.0 110.253 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.442 ' HA ' ' CD2' ' B' ' 88' ' ' HIS . . . -55.32 -32.78 62.76 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.3 0.572 . . . . 0.0 110.663 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.634 ' CG1' ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.34 -17.29 9.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.727 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.41 12.1 18.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.368 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.89 -39.66 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.678 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.459 ' NE2' ' CE2' ' B' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.63 12.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.819 0.343 . . . . 0.0 111.143 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.69 89.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.154 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.1 m 176.54 107.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.626 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . 0.401 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 75.91 -49.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.156 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 C--N 1.333 -0.13 0 CA-C-O 120.862 0.363 . . . . 0.0 111.663 -179.95 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 121.482 0.658 . . . . 0.0 111.392 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 6' ' ' THR . 0.7 OUTLIER -45.01 -48.24 11.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.303 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.522 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 19.7 m -65.26 -39.7 92.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.385 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 4' ' ' THR . 1.3 mm-40 -51.76 -45.91 63.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.498 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -26.78 60.93 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.534 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 0.2 OUTLIER -63.6 -52.31 61.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.956 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.595 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -55.69 -57.12 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 120.694 0.283 . . . . 0.0 111.056 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.481 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.8 OUTLIER -54.59 -27.42 38.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.025 0.44 . . . . 0.0 110.756 179.5 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.541 ' CB ' ' HB2' ' B' ' 9' ' ' CYS . 0.1 OUTLIER -63.07 -55.51 24.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.081 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.892 ' O ' HG23 ' A' ' 16' ' ' VAL . 4.0 mm? -72.14 -30.97 65.55 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.762 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.5 mt -69.8 -38.25 75.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 111.95 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.65 64.06 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.678 -1.147 . . . . 0.0 112.023 -176.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 13' ' ' LEU . 15.9 m -52.27 -40.0 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.615 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 31.3 t80 -72.85 -58.21 3.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.296 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.762 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.0 mm-40 -49.09 -49.02 43.74 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -51.28 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.525 -178.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.442 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.6 m-85 -80.59 -26.87 37.61 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.59 0.709 . . . . 0.0 110.206 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.615 ' HB1' ' O ' ' A' ' 17' ' ' PHE . . . -90.39 20.07 4.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.781 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.26 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.556 -179.918 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.8 m . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.595 0.236 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 24.1 p -155.17 -176.91 6.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.989 0.423 . . . . 0.0 110.812 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.465 ' HB2' ' CE1' ' A' ' 17' ' ' PHE . 0.3 OUTLIER -147.78 -123.16 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.261 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -173.7 129.23 0.41 Allowed 'General case' 0 C--O 1.231 0.088 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.408 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -49.91 -40.71 44.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.165 -179.136 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.696 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.44 -42.72 67.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.936 0.398 . . . . 0.0 110.041 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 3.0 mt-10 -56.01 -29.65 60.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -68.62 -34.88 76.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.535 178.441 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.696 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -53.37 -59.08 5.03 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.699 0.761 . . . . 0.0 111.192 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.433 ' O ' HG21 ' A' ' 41' ' ' THR . 3.0 t -57.88 -27.75 63.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.34 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.428 ' O ' HG21 ' A' ' 41' ' ' THR . 8.7 t80 -57.69 -50.39 73.35 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.012 0.434 . . . . 0.0 110.267 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.481 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.39 -44.14 95.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.444 0.64 . . . . 0.0 110.107 179.05 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.44 -19.29 64.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.932 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 37' ' ' SER . 8.3 t -107.61 -52.69 2.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -128.09 29.2 5.42 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -177.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.8 mt -166.7 45.8 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.17 0.51 . . . . 0.0 110.604 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.87 -30.0 61.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.361 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.47 -29.49 61.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.879 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -83.28 -4.63 58.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.409 ' CG2' ' HB3' ' A' ' 39' ' ' MET . 1.4 p . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.668 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 CA--C 1.527 0.06 0 CA-C-O 120.918 0.39 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.411 HD12 ' HG2' ' A' ' 39' ' ' MET . 7.0 tt -75.16 -52.15 11.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.969 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.48 -26.81 44.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.028 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -53.79 30.68 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.665 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -75.55 -43.09 50.41 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.11 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.412 ' HA ' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.664 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.891 0.377 . . . . 0.0 111.109 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.457 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER -69.37 -137.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.633 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 2.5 t70 173.72 161.49 0.16 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.466 0.575 . . . . 0.0 110.879 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.53 ' HB2' HG13 ' B' ' 85' ' ' VAL . 51.5 p90 -55.39 -58.85 6.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.289 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -79.96 -22.59 42.44 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 119.824 -0.751 . . . . 0.0 110.516 -179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.832 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.5 mt-10 -44.76 -38.09 4.22 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.506 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 1.4 t80 -76.84 -54.71 6.25 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 177.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.484 HD12 HD12 ' B' ' 77' ' ' LEU . 0.0 OUTLIER -48.55 -33.94 10.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.599 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -76.38 -52.39 9.99 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.686 178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.974 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -58.5 -59.07 5.95 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.951 -179.073 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.477 HG23 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.24 -41.41 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 O-C-N 123.606 0.566 . . . . 0.0 111.212 179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.457 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.83 -50.82 48.55 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 119.68 -1.247 . . . . 0.0 110.22 178.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -60.71 -35.91 90.66 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 120.455 -0.879 . . . . 0.0 111.846 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.974 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.8 mt -63.92 -38.32 90.66 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.403 ' HB2' ' CD1' ' B' ' 14' ' ' ILE . . . -55.3 -35.73 65.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.095 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.529 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.81 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.67 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.86 16.14 18.46 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.163 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.406 ' N ' ' O ' ' A' ' 83' ' ' LEU . 45.1 t -162.76 -42.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.825 -179.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.525 ' HB3' HD13 ' B' ' 14' ' ' ILE . 0.6 OUTLIER -99.01 78.78 2.29 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 111.855 -179.013 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 90' ' ' SER . 6.0 mp0 53.37 -163.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.292 179.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 3.2 m 81.7 -69.56 0.08 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.247 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.57 -37.52 4.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.054 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.825 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.429 0.633 . . . . 0.0 111.476 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' B' ' 6' ' ' THR . 0.7 OUTLIER -44.96 -48.25 11.4 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.255 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.524 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 20.1 m -65.31 -39.69 92.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.326 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 4' ' ' THR . 1.3 mm-40 -51.74 -45.87 63.83 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.458 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -26.77 60.86 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.541 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -63.48 -52.41 61.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.032 179.791 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.601 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -55.6 -57.07 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.638 0.256 . . . . 0.0 111.117 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.5 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.8 OUTLIER -54.67 -27.43 40.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 110.729 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.534 ' CB ' ' HB2' ' A' ' 9' ' ' CYS . 0.1 OUTLIER -63.05 -55.52 24.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.084 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.896 ' O ' HG23 ' B' ' 16' ' ' VAL . 4.0 mm? -72.16 -31.02 65.56 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.758 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.6 mt -69.8 -38.2 75.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.344 0.592 . . . . 0.0 111.902 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.18 -34.58 63.82 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.963 -176.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.896 HG23 ' O ' ' B' ' 13' ' ' LEU . 16.0 m -52.27 -40.07 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 177.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.632 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 31.4 t80 -72.77 -58.1 3.6 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.422 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.758 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.0 mm-40 -49.32 -48.84 46.04 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.28 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.66 -51.25 22.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.511 -178.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.441 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.6 m-85 -80.53 -26.9 37.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.521 0.677 . . . . 0.0 110.144 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.632 ' HB1' ' O ' ' B' ' 17' ' ' PHE . . . -90.4 20.03 4.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.705 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.594 -179.906 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.692 0.282 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 24.2 p -155.16 -176.98 6.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.016 0.436 . . . . 0.0 110.839 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.468 ' HB2' ' CE1' ' B' ' 17' ' ' PHE . 0.3 OUTLIER -147.74 -123.2 0.06 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.31 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -173.66 129.21 0.42 Allowed 'General case' 0 C--O 1.231 0.116 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.413 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -49.8 -40.79 42.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.19 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.711 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.34 -42.77 68.12 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.075 179.591 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 3.0 mt-10 -55.92 -29.77 60.58 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -68.57 -34.86 76.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.521 178.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.711 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -53.4 -59.12 4.99 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 111.123 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' SER . . . . . 0.43 ' O ' HG21 ' B' ' 41' ' ' THR . 3.0 t -57.84 -27.74 63.47 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.386 -178.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.422 ' O ' HG21 ' B' ' 41' ' ' THR . 8.6 t80 -57.64 -50.49 72.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.979 0.418 . . . . 0.0 110.26 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.498 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -60.32 -44.07 95.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.438 0.637 . . . . 0.0 110.147 179.064 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -63.5 -19.29 64.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.92 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.43 HG21 ' O ' ' B' ' 37' ' ' SER . 8.2 t -107.68 -52.59 2.74 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' B' ' 43' ' ' LEU . 0.9 OUTLIER -128.16 29.2 5.41 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.158 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 7.8 mt -166.7 45.81 0.06 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.138 0.494 . . . . 0.0 110.604 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.83 -29.95 61.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.431 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.49 -29.5 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.856 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -83.32 -4.61 58.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.201 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.407 ' CG2' ' HB3' ' B' ' 39' ' ' MET . 1.4 p . . . . . 0 CA--C 1.53 0.207 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.705 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.912 0.386 . . . . 0.0 111.534 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.406 ' C ' ' CD2' ' B' ' 56' ' ' LEU . 7.0 tt -75.11 -52.23 11.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.976 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.52 -26.77 44.91 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.02 -178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -53.75 31.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.676 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -75.53 -43.09 50.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.404 ' HA ' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.683 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.417 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.88 0.372 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.459 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.4 OUTLIER -69.25 -137.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.632 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 2.5 t70 173.69 161.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.409 0.55 . . . . 0.0 110.969 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.529 ' HB2' HG13 ' A' ' 85' ' ' VAL . 51.6 p90 -55.37 -58.83 6.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.4 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.584 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.2 OUTLIER -79.92 -22.55 42.59 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.556 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.826 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.5 mt-10 -44.81 -38.11 4.29 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 1.4 t80 -76.77 -54.71 6.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.484 HD12 HD12 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -48.6 -33.85 10.54 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 177.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -76.48 -52.36 9.96 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.654 178.027 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.969 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -58.55 -58.94 6.35 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.977 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.483 HG23 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -72.27 -41.53 65.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 O-C-N 123.572 0.545 . . . . 0.0 111.158 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.454 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.72 -50.82 47.87 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 119.75 -1.215 . . . . 0.0 110.261 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -60.77 -35.88 90.77 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.847 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.969 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.9 mt -63.87 -38.35 90.77 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.58 65.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.098 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.53 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.54 -17.89 9.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 114.732 -1.122 . . . . 0.0 111.706 -179.538 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.78 15.98 18.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.13 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.416 ' N ' ' O ' ' B' ' 83' ' ' LEU . 45.3 t -162.74 -42.41 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.852 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.515 ' HB3' HD13 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -99.12 78.86 2.28 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.923 0.392 . . . . 0.0 111.869 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' B' ' 90' ' ' SER . 6.0 mp0 53.37 -163.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.415 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' SER . . . . . 0.417 ' HB2' HG11 ' B' ' 85' ' ' VAL . 3.2 m 81.72 -69.64 0.08 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.241 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.51 -37.52 4.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.103 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.364 -179.815 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.425 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 121.328 0.585 . . . . 0.0 111.049 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.76 -46.44 10.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.114 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.507 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.19 -41.76 96.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.18 0.514 . . . . 0.0 109.932 179.057 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 1.5 mt-10 -51.66 -34.71 39.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.37 -35.43 40.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.842 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.434 ' SG ' HD22 ' B' ' 13' ' ' LEU . 3.4 p -65.45 -40.7 93.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.066 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.61 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.6 mp -69.89 -56.17 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.402 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.488 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.1 -27.47 14.18 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.604 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.554 ' O ' HG13 ' A' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.887 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.913 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.9 mm? -59.75 -29.67 68.33 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.118 0.485 . . . . 0.0 112.086 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 8.0 mt -70.66 -39.04 75.37 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 CA-C-O 121.541 0.686 . . . . 0.0 110.539 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.5 -32.79 58.53 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.293 -176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.913 HG21 ' O ' ' A' ' 13' ' ' LEU . 25.0 m -52.09 -39.09 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 9.1 t80 -77.85 -58.47 3.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.917 179.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.755 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.6 mm-40 -48.84 -30.97 6.39 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -51.56 68.95 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.804 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.459 ' HB3' HD23 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.05 -49.38 10.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.794 0.807 . . . . 0.0 109.962 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.551 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -57.25 -52.12 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.782 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 -179.964 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.99 0.424 . . . . 0.0 111.064 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 31.7 p -123.57 -178.33 3.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.262 0.553 . . . . 0.0 111.031 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.551 ' HG ' ' CA ' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -131.73 -139.86 0.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.787 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.437 ' N ' HD21 ' A' ' 30' ' ' LEU . 1.3 p -164.33 136.72 4.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 3.4 pttt -49.72 -35.76 23.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.925 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.825 ' HA ' ' CD2' ' A' ' 36' ' ' LEU . 12.9 m -74.28 -53.18 10.26 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.856 -0.338 . . . . 0.0 111.779 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 20' ' ' TYR . 25.4 mt-10 -55.63 -28.2 53.96 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.54 ' CE2' ' CD2' ' A' ' 76' ' ' PHE . 1.3 t80 -78.18 -43.02 29.73 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.209 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.825 ' CD2' ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -68.23 -21.02 64.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.48 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -80.99 -26.55 36.42 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.141 0.496 . . . . 0.0 109.831 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.458 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 45.8 t80 -69.5 -24.48 63.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.666 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.418 ' O ' ' C ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -72.44 -41.68 65.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.615 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -19.4 60.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.4 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.4 p -106.32 -76.53 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 38' ' ' PHE . 2.0 mm-40 -68.41 -33.15 73.71 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.422 HD11 HD13 ' A' ' 83' ' ' LEU . 15.5 mt -121.95 43.73 2.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.074 0.464 . . . . 0.0 110.686 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.68 -25.02 58.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.809 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.08 -23.23 67.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.812 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -95.55 -27.89 15.13 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.915 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.839 -179.931 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.6 t . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 121.066 0.46 . . . . 0.0 111.437 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.8 tp -75.1 -51.23 13.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.65 -33.76 64.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.489 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -40.31 95.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.694 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.539 ' CG ' ' N ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -61.69 -54.21 45.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.041 0.448 . . . . 0.0 111.199 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.539 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.431 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.598 ' HA ' HE21 ' A' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.903 0.382 . . . . 0.0 111.119 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.72 -142.5 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.403 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.41 ' O ' ' CE2' ' A' ' 17' ' ' PHE . 0.3 OUTLIER 171.74 -178.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.23 0.538 . . . . 0.0 111.731 179.121 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.583 ' CG ' HG12 ' B' ' 85' ' ' VAL . 43.5 p90 -61.77 -58.15 9.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.639 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.466 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 43.0 tp60 -74.74 -25.38 59.07 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.608 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.95 -37.57 4.07 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.54 ' CD2' ' CE2' ' A' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.47 5.73 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.833 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.442 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 6.5 mt -53.98 -33.89 58.26 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.466 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.79 -50.05 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.242 177.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 5.0 mp -58.05 -57.52 12.47 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.016 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.592 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.1 OUTLIER -71.1 -46.03 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.027 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.442 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.91 -50.13 51.96 Favored Glycine 0 C--N 1.333 0.412 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.412 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.65 -35.12 37.17 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.687 178.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.6 mt -61.74 -45.99 91.57 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.965 0.412 . . . . 0.0 109.979 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.81 62.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.873 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.583 HG12 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.41 9.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.649 -179.598 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.73 13.01 17.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.341 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.77 -39.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.578 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.402 ' HB3' HD11 ' B' ' 14' ' ' ILE . 1.4 t-80 -107.39 67.15 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.697 0.284 . . . . 0.0 111.737 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.7 -168.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m 76.09 5.51 3.75 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.652 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 170.35 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.165 179.976 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.432 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.317 0.58 . . . . 0.0 111.142 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.69 -46.48 10.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.094 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.502 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.16 -41.82 97.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.894 179.048 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.432 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 1.5 mt-10 -51.65 -34.71 39.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.936 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.41 -35.38 40.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.757 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.433 ' SG ' HD22 ' A' ' 13' ' ' LEU . 3.4 p -65.62 -40.59 92.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.07 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.611 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.6 mp -69.85 -56.2 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.412 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.14 -27.43 14.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.878 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.9 mm? -59.84 -29.56 68.36 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.12 0.486 . . . . 0.0 112.085 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.77 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 8.0 mt -70.73 -38.96 74.99 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 121.478 0.656 . . . . 0.0 110.526 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.8 58.43 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.387 -1.279 . . . . 0.0 112.311 -176.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.902 HG21 ' O ' ' B' ' 13' ' ' LEU . 25.2 m -52.15 -39.05 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 177.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 9.0 t80 -77.9 -58.52 3.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.839 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.7 mm-40 -48.91 -30.84 6.36 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -51.65 68.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.702 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.457 ' HB3' HD23 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.94 -49.39 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.869 0.842 . . . . 0.0 109.995 178.459 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.55 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -57.28 -52.08 66.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.23 -1.35 . . . . 0.0 111.859 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.987 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.004 0.431 . . . . 0.0 111.018 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.41 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 31.9 p -123.65 -178.36 4.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.248 0.546 . . . . 0.0 111.025 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.55 ' HG ' ' CA ' ' B' ' 21' ' ' ALA . 0.4 OUTLIER -131.63 -139.83 0.21 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.877 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.429 ' N ' HD21 ' B' ' 30' ' ' LEU . 1.3 p -164.43 136.63 4.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' B' ' 36' ' ' LEU . 3.4 pttt -49.59 -35.67 21.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.991 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.824 ' HA ' ' CD2' ' B' ' 36' ' ' LEU . 12.5 m -74.46 -53.06 10.28 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.755 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.456 ' HB3' ' CD1' ' B' ' 20' ' ' TYR . 25.4 mt-10 -55.68 -28.17 54.14 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.547 ' CE2' ' CD2' ' B' ' 76' ' ' PHE . 1.3 t80 -78.27 -42.95 29.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.183 178.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.824 ' CD2' ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -68.3 -20.98 64.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.474 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -81.03 -26.54 36.31 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.133 0.492 . . . . 0.0 109.832 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.454 ' CZ ' ' CB ' ' B' ' 42' ' ' GLU . 45.9 t80 -69.46 -24.54 63.81 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.588 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.421 ' O ' ' C ' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -72.39 -41.65 66.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.611 -179.595 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.08 -19.34 60.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.349 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 28.5 p -106.32 -76.68 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.454 ' CB ' ' CZ ' ' B' ' 38' ' ' PHE . 2.0 mm-40 -68.33 -33.06 73.61 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' B' ' 39' ' ' MET . 15.3 mt -122.16 43.93 2.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.134 0.492 . . . . 0.0 110.589 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.69 -25.03 58.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.88 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.05 -23.24 67.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.784 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -95.59 -27.94 15.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.934 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.918 -179.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.7 t . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 121.078 0.466 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.4 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -75.06 -51.24 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.723 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.62 -33.76 64.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.508 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -40.3 95.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.548 ' CG ' ' N ' ' B' ' 60' ' ' MET . 0.0 OUTLIER -61.78 -54.24 45.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.176 -179.4 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.548 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.687 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.48 -179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.59 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.775 0.321 . . . . 0.0 111.233 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.469 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -65.86 -142.44 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.417 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' B' ' 17' ' ' PHE . 0.3 OUTLIER 171.75 -178.29 0.06 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.197 0.523 . . . . 0.0 111.799 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.583 ' CG ' HG12 ' A' ' 85' ' ' VAL . 44.0 p90 -61.77 -58.22 8.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.648 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.463 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 42.9 tp60 -74.67 -25.37 59.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.623 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.509 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.87 -37.63 4.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.192 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.547 ' CD2' ' CE2' ' B' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.33 5.86 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.866 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.439 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 6.4 mt -54.15 -33.81 58.86 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.463 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.85 -50.02 14.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.233 177.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.537 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 5.0 mp -58.01 -57.65 11.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.955 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.591 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -70.94 -46.13 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.071 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.439 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.89 -50.22 51.43 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.412 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.15 36.5 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.68 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.7 mt -61.66 -45.98 91.7 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 121.032 0.444 . . . . 0.0 110.009 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.39 -31.7 62.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.007 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.583 HG12 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.38 -17.52 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.61 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.63 12.96 17.34 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.361 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.79 -39.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.625 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.409 ' HB3' HD11 ' A' ' 14' ' ' ILE . 1.4 t-80 -107.29 67.07 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.75 -168.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.363 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 7.8 m 76.1 5.4 3.75 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.622 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 170.36 -52.04 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.78 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.126 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.425 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.191 0 CA-C-O 121.374 0.607 . . . . 0.0 111.059 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.81 -47.76 10.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.034 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.474 HG23 HD12 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -63.42 -39.18 93.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.218 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.6 OUTLIER -52.28 -34.28 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.39 -39.68 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.01 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.436 ' HB2' HD23 ' B' ' 13' ' ' LEU . 2.8 p -58.6 -42.47 88.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.431 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.555 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -67.5 -56.05 14.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.906 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.482 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.88 -27.34 12.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.538 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.507 ' O ' HG12 ' A' ' 16' ' ' VAL . 3.5 m -71.58 -55.84 7.0 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.904 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -63.55 -28.42 69.93 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.5 mt -70.64 -37.01 67.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.574 0.702 . . . . 0.0 110.645 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.47 -33.08 58.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.278 -176.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.904 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.5 m -53.19 -38.95 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 177.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.495 ' CE2' ' HB2' ' A' ' 30' ' ' LEU . 2.0 t80 -75.25 -57.7 3.73 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.535 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.755 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -48.87 -30.39 5.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -52.12 66.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.501 -0.479 . . . . 0.0 111.147 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.418 ' CE1' ' HB2' ' A' ' 38' ' ' PHE . 17.4 m-85 -81.17 -47.81 12.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 17' ' ' PHE . . . -56.98 -25.05 57.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.645 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.349 -179.887 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.586 0.232 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.434 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 16.6 p -139.32 178.73 6.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.127 0.489 . . . . 0.0 111.148 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.495 ' HB2' ' CE2' ' A' ' 17' ' ' PHE . 1.3 tt -125.27 -115.28 0.29 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.968 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.494 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 43.2 t 176.01 129.14 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.67 -35.7 22.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.2 -44.15 54.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.44 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.7 OUTLIER -58.48 -28.84 65.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 0.0 110.1 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -70.49 -27.95 64.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.917 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.704 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.46 -58.98 5.72 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.677 0.751 . . . . 0.0 111.121 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.41 ' O ' ' CG2' ' A' ' 41' ' ' THR . 3.1 m -56.17 -44.09 79.02 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.46 -178.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.426 ' HA ' ' CG2' ' A' ' 41' ' ' THR . 10.2 t80 -57.57 -29.08 64.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.812 0.339 . . . . 0.0 110.748 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.436 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -76.52 -41.28 47.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.099 0.476 . . . . 0.0 110.759 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -73.67 -19.46 60.82 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.244 -179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.426 ' CG2' ' HA ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -98.18 -66.93 0.87 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -20.98 18.12 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -176.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 31.3 mt -120.61 45.89 2.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.203 0.525 . . . . 0.0 110.59 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -32.08 35.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.077 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.47 -23.65 51.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.839 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.43 ' CD1' HD21 ' A' ' 43' ' ' LEU . 77.3 m-85 -90.42 -8.48 50.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.112 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.41 ' CG2' ' HG2' ' A' ' 39' ' ' MET . 6.7 p . . . . . 0 C--N 1.332 -0.177 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.008 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.782 0.325 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -50.37 67.98 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.89 -45.13 78.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -25.33 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.891 0.377 . . . . 0.0 110.967 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.833 ' HB3' ' HG ' ' A' ' 79' ' ' LEU . 9.5 mmm -65.62 -54.6 25.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.489 0.662 . . . . 0.0 112.006 -179.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.445 ' HA ' ' CE ' ' A' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.239 0 CA-C-N 114.722 -1.127 . . . . 0.0 112.409 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.434 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.862 0.363 . . . . 0.0 111.15 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.494 ' HB2' ' N ' ' A' ' 31' ' ' SER . 0.4 OUTLIER -69.56 -140.7 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.542 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.429 ' O ' ' CE2' ' A' ' 17' ' ' PHE . 0.6 OUTLIER 173.45 169.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 0.0 111.062 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.472 ' CB ' ' CG1' ' B' ' 85' ' ' VAL . 2.8 m-85 -59.13 -62.33 1.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.91 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 78' ' ' ASN . 50.0 tp60 -67.84 -28.86 67.91 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.65 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.51 -40.53 5.69 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 110.28 179.7 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' CG2' ' A' ' 16' ' ' VAL . 1.7 t80 -72.05 -53.99 11.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.277 178.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.403 HD23 ' CB ' ' A' ' 13' ' ' LEU . 5.7 mt -54.75 -33.81 61.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.4 m-20 -74.41 -49.85 20.9 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.38 178.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.897 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 7.3 mp -65.03 -58.29 6.46 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.721 -179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.543 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -65.91 -46.68 87.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 O-C-N 123.351 0.407 . . . . 0.0 111.259 179.481 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.452 ' N ' ' CG2' ' A' ' 80' ' ' ILE . . . -55.72 -50.43 60.83 Favored Glycine 0 CA--C 1.506 -0.488 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.42 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -55.61 -29.89 54.96 Favored Glycine 0 CA--C 1.523 0.54 0 C-N-CA 120.411 -0.9 . . . . 0.0 111.663 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.897 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 24.6 mt -66.57 -47.32 73.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.075 0.464 . . . . 0.0 110.198 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.21 -34.71 64.16 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.801 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.468 ' CG1' ' CB ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.08 -17.56 9.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.31 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HA ' HG12 ' A' ' 92' ' ' VAL . . . -116.06 16.61 16.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.358 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' A' ' 83' ' ' LEU . 22.6 t -163.55 -30.85 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 57.2 t60 -84.5 51.73 2.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.817 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.64 32.6 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.401 ' OG ' ' CE2' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -94.17 -67.03 0.88 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.486 179.623 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.19 -35.96 7.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.337 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.415 HG12 ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.878 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.356 0.598 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.84 -47.73 11.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.027 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.477 HG23 HD12 ' B' ' 10' ' ' ILE . 0.9 OUTLIER -63.44 -39.13 93.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.247 179.221 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' B' ' 4' ' ' THR . 0.6 OUTLIER -52.39 -34.24 47.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.705 179.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.42 -39.58 32.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.987 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.42 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 2.8 p -58.64 -42.51 88.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.372 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.545 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -67.57 -56.05 14.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.819 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.48 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.9 -27.23 12.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.494 ' O ' HG12 ' B' ' 16' ' ' VAL . 3.5 m -71.75 -55.67 7.2 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.905 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -63.68 -28.36 69.84 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.767 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.5 mt -70.73 -36.96 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.562 0.696 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.54 -33.08 58.57 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.233 -176.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.905 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.7 m -53.23 -38.86 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.491 ' CE2' ' HB2' ' B' ' 30' ' ' LEU . 2.0 t80 -75.24 -57.75 3.71 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.58 179.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.767 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -48.96 -30.38 5.91 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -52.29 65.96 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.101 -178.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' B' ' 38' ' ' PHE . 17.4 m-85 -81.04 -47.89 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.767 0.794 . . . . 0.0 109.873 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' B' ' 17' ' ' PHE . . . -56.87 -25.08 55.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.632 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.389 -179.842 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.641 0.258 . . . . 0.0 111.579 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 16.6 p -139.3 178.77 6.95 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.141 0.496 . . . . 0.0 111.166 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.491 ' HB2' ' CE2' ' B' ' 17' ' ' PHE . 1.3 tt -125.29 -115.34 0.28 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.951 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.503 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 43.4 t 176.01 129.16 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -35.79 23.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.914 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.722 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.07 -44.2 54.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.886 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.7 OUTLIER -58.57 -28.78 65.86 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.094 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -70.38 -28.09 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.964 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.722 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.51 -58.89 6.07 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.714 0.769 . . . . 0.0 111.057 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' SER . . . . . 0.414 ' O ' ' CG2' ' B' ' 41' ' ' THR . 3.2 m -56.13 -44.18 78.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.421 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.422 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 10.2 t80 -57.47 -29.14 64.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.899 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.434 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -76.5 -41.34 47.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.692 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -73.61 -19.49 60.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.221 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.416 ' CG2' ' HA ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -98.22 -66.93 0.87 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -177.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -96.23 -20.92 18.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 -176.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.435 HD21 ' CD1' ' B' ' 46' ' ' PHE . 31.6 mt -120.57 45.78 2.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.618 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.75 -32.14 35.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.998 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.51 -23.67 51.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.754 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.435 ' CD1' HD21 ' B' ' 43' ' ' LEU . 77.2 m-85 -90.35 -8.52 50.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.18 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.403 ' CG2' ' HG2' ' B' ' 39' ' ' MET . 6.6 p . . . . . 0 C--N 1.333 -0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.024 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 120.787 0.327 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -50.28 68.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.84 -45.2 78.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -25.23 62.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.95 0.405 . . . . 0.0 111.024 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.855 ' HB3' ' HG ' ' B' ' 79' ' ' LEU . 9.5 mmm -65.65 -54.62 25.13 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.497 0.665 . . . . 0.0 112.021 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.448 ' CE ' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.2 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.436 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.419 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.933 0.397 . . . . 0.0 111.122 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.503 ' HB2' ' N ' ' B' ' 31' ' ' SER . 0.4 OUTLIER -69.66 -140.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.429 ' O ' ' CE2' ' B' ' 17' ' ' PHE . 0.6 OUTLIER 173.36 169.86 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.933 0.396 . . . . 0.0 111.044 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.468 ' CB ' ' CG1' ' A' ' 85' ' ' VAL . 2.8 m-85 -59.16 -62.32 1.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.86 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' B' ' 78' ' ' ASN . 49.9 tp60 -67.97 -28.75 67.72 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.625 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.54 -40.52 5.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 110.201 179.688 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.462 ' CE1' ' CG2' ' B' ' 16' ' ' VAL . 1.7 t80 -72.05 -54.04 11.05 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.294 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.413 HD23 ' CB ' ' B' ' 13' ' ' LEU . 5.7 mt -54.68 -33.84 61.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.402 0.62 . . . . 0.0 109.516 178.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.4 m-20 -74.44 -49.85 20.78 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.33 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.895 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 7.2 mp -65.01 -58.31 6.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.732 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.541 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -65.97 -46.55 87.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 O-C-N 123.386 0.429 . . . . 0.0 111.283 179.524 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.456 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -55.72 -50.47 60.61 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.44 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -55.45 -30.03 54.68 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.467 -0.873 . . . . 0.0 111.69 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.895 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 24.7 mt -66.69 -47.22 73.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.043 0.449 . . . . 0.0 110.177 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.24 -34.81 64.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.689 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.472 ' CG1' ' CB ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.03 -17.48 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.364 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . 0.411 ' HA ' HG12 ' B' ' 92' ' ' VAL . . . -116.09 16.56 16.0 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.244 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' B' ' 83' ' ' LEU . 22.8 t -163.53 -30.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 57.1 t60 -84.48 51.72 2.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.831 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.62 32.57 0.06 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' SER . . . . . 0.409 ' OG ' ' CE2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -94.09 -67.04 0.88 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 110.486 179.645 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.15 -36.05 7.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.389 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' B' ' 86' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.957 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.448 HG21 ' HB2' ' A' ' 7' ' ' GLU . 10.1 t . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 121.67 0.748 . . . . 0.0 111.263 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.9 -48.04 11.24 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.868 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.515 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 19.9 m -67.11 -34.42 77.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.736 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.467 ' HA ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -51.91 -45.98 64.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.882 0.373 . . . . 0.0 110.579 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -26.81 66.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.401 178.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.431 ' HA ' ' HB3' ' B' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.678 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.581 ' O ' HG13 ' A' ' 14' ' ' ILE . 1.6 mp -48.9 -56.11 2.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.877 0.37 . . . . 0.0 111.652 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.535 ' HA ' HD11 ' A' ' 14' ' ' ILE . 5.2 mt-10 -51.85 -27.19 11.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.722 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.51 ' O ' HG11 ' A' ' 16' ' ' VAL . 3.4 m -62.09 -55.9 24.26 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.968 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -76.04 -27.83 57.46 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.763 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.2 mt -67.15 -37.3 78.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.489 0.662 . . . . 0.0 111.008 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.92 -32.59 57.48 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.565 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.968 HG22 ' O ' ' A' ' 13' ' ' LEU . 22.1 m -52.02 -38.2 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.502 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 7.6 t80 -77.4 -58.42 3.29 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.244 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.763 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.7 mm-40 -49.12 -25.61 2.25 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.3 -52.74 36.84 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.916 -178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.516 ' HB3' HD23 ' A' ' 30' ' ' LEU . 8.1 m-85 -81.6 -39.47 24.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.828 0.823 . . . . 0.0 109.894 178.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 17' ' ' PHE . . . -70.6 -27.82 64.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.853 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.567 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.695 0.283 . . . . 0.0 111.48 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 2.5 p -134.93 154.76 51.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.681 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -111.05 -136.39 0.37 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.918 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -168.01 133.84 1.94 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.771 0.32 . . . . 0.0 110.539 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.86 -39.97 40.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.728 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -69.17 -46.63 67.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.435 ' HB3' HD22 ' A' ' 30' ' ' LEU . 3.1 mt-10 -57.76 -29.74 65.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.033 0.444 . . . . 0.0 110.287 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.505 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -69.31 -29.4 67.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.111 179.012 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.728 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -51.73 -59.06 4.73 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.636 0.731 . . . . 0.0 111.297 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -47.23 81.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.57 -1.195 . . . . 0.0 111.386 -178.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.436 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 10.8 t80 -57.73 -51.07 71.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.673 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.551 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -73.53 -19.84 60.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.881 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -118.97 -80.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.107 0.479 . . . . 0.0 111.501 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 38' ' ' PHE . 2.2 mm-40 -46.0 -38.58 7.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.027 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.425 HD22 ' CD1' ' A' ' 46' ' ' PHE . 23.3 mt -130.69 50.8 2.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.937 0.399 . . . . 0.0 110.679 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.78 -35.19 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.099 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.98 -25.06 57.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.162 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.454 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 43.6 m-85 -91.97 15.09 13.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.3 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.492 179.769 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 CA--C 1.526 0.052 0 CA-C-O 120.766 0.317 . . . . 0.0 111.404 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.445 ' O ' ' HG2' ' A' ' 59' ' ' MET . 0.2 OUTLIER -67.81 -51.68 45.85 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.152 0.501 . . . . 0.0 110.488 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.409 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 1.7 t0 -55.11 -26.83 40.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.905 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.97 -47.26 85.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.682 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.791 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 5.1 ptp -69.31 -53.78 17.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.573 ' N ' ' HG3' ' A' ' 59' ' ' MET . 2.0 mtm . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.544 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.1 mm-40 . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.699 0.285 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.681 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -64.49 -132.79 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.663 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.485 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 2.3 t0 176.71 -171.37 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.81 0.732 . . . . 0.0 111.444 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.584 ' HB2' HG13 ' B' ' 85' ' ' VAL . 44.4 p90 -77.6 -54.87 5.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.489 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.478 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -77.63 -30.36 52.19 Favored 'General case' 0 CA--C 1.515 -0.37 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.326 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.83 -33.1 1.8 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.52 ' CE1' HG21 ' A' ' 16' ' ' VAL . 2.0 t80 -80.44 -54.4 5.73 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.847 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.427 HD21 HD21 ' B' ' 77' ' ' LEU . 6.9 mt -55.98 -33.37 64.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.14 -39.68 54.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.135 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.791 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.7 mp -64.56 -57.77 8.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.748 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.572 HG21 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.82 -43.71 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.139 179.427 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.71 -50.31 49.93 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.005 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -51.71 -35.52 38.57 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.359 -0.924 . . . . 0.0 111.427 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.554 ' CD2' ' HE1' ' A' ' 59' ' ' MET . 8.4 mt -62.19 -46.07 90.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.921 0.391 . . . . 0.0 110.098 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.32 -35.42 65.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 110.849 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.578 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -81.09 -17.15 12.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.115 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -117.35 15.72 14.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.552 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -160.99 -27.43 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -179.443 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.508 ' HB2' ' O ' ' A' ' 84' ' ' ALA . 14.2 m-70 -93.79 27.56 2.68 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.611 -0.436 . . . . 0.0 112.159 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 59.34 16.51 5.11 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.402 ' CB ' ' HA ' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -72.94 -50.7 21.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.949 0.404 . . . . 0.0 109.95 179.334 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.434 ' HB2' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -113.03 -38.75 4.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.779 178.775 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.087 179.56 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.45 HG21 ' HB2' ' B' ' 7' ' ' GLU . 10.1 t . . . . . 0 CA--C 1.517 -0.298 0 CA-C-O 121.625 0.726 . . . . 0.0 111.328 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.88 -48.14 11.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.801 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.509 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 19.8 m -67.06 -34.33 77.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.762 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.48 ' HA ' HD13 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -51.99 -45.95 64.68 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.534 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -26.8 66.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.09 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.655 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.582 ' O ' HG13 ' B' ' 14' ' ' ILE . 1.6 mp -48.94 -56.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.543 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.551 ' HA ' HD11 ' B' ' 14' ' ' ILE . 5.3 mt-10 -51.77 -27.27 11.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.7 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.5 ' O ' HG11 ' B' ' 16' ' ' VAL . 3.3 m -62.07 -55.83 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.968 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -76.17 -27.75 57.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.752 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.1 mt -67.19 -37.27 78.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 O-C-N 121.558 -0.714 . . . . 0.0 110.964 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.99 -32.63 57.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.469 -1.241 . . . . 0.0 112.539 -176.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.968 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.0 m -52.05 -38.17 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.51 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 7.5 t80 -77.46 -58.38 3.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.155 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.752 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.7 mm-40 -49.17 -25.65 2.33 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.13 -52.83 36.83 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.891 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.519 ' HB3' HD23 ' B' ' 30' ' ' LEU . 8.1 m-85 -81.63 -39.44 24.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.808 0.813 . . . . 0.0 109.864 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' B' ' 17' ' ' PHE . . . -70.64 -27.83 64.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.816 -179.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.629 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.0 p . . . . . 0 CA--C 1.528 0.112 0 CA-C-O 120.709 0.29 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.555 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 2.4 p -135.05 154.85 51.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.535 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.683 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.2 OUTLIER -111.02 -136.37 0.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.015 179.817 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -167.98 133.82 1.95 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.756 0.312 . . . . 0.0 110.577 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -39.97 40.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.96 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.728 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -69.2 -46.65 66.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.58 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' B' ' 30' ' ' LEU . 3.1 mt-10 -57.76 -29.76 65.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.953 0.406 . . . . 0.0 110.195 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.503 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -69.25 -29.51 67.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.069 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.728 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.61 -59.02 4.74 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.664 0.745 . . . . 0.0 111.371 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.42 -47.16 82.49 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.346 -178.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.44 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 10.9 t80 -57.76 -51.07 71.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.65 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -30.93 71.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.547 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -73.48 -19.8 60.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.843 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -119.02 -80.38 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 0.0 111.491 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.434 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.1 mm-40 -46.03 -38.56 8.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.031 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.435 HD22 ' CD1' ' B' ' 46' ' ' PHE . 23.4 mt -130.77 50.81 2.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.982 0.42 . . . . 0.0 110.662 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.77 -35.21 33.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.068 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.05 -24.99 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.175 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 43.9 m-85 -91.87 14.96 14.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.133 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 26.3 p . . . . . 0 C--N 1.331 -0.208 0 CA-C-O 120.95 0.405 . . . . 0.0 110.445 179.859 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.741 0.305 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' B' ' 59' ' ' MET . 0.2 OUTLIER -67.77 -51.71 45.72 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.216 0.532 . . . . 0.0 110.536 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . 0.409 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 1.7 t0 -55.09 -26.87 40.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.881 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -47.19 86.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.799 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 5.1 ptp -69.44 -53.81 17.48 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.908 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.572 ' N ' ' HG3' ' B' ' 59' ' ' MET . 2.0 mtm . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.776 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.555 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.1 mm-40 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.762 0.315 . . . . 0.0 111.386 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.683 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -64.48 -132.81 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.46 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 2.3 t0 176.67 -171.37 0.08 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.798 0.727 . . . . 0.0 111.409 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.578 ' HB2' HG13 ' A' ' 85' ' ' VAL . 44.4 p90 -77.65 -54.96 5.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.433 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -77.57 -30.38 52.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.319 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.79 -33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.858 0.361 . . . . 0.0 110.155 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.527 ' CE1' HG21 ' B' ' 16' ' ' VAL . 2.0 t80 -80.32 -54.42 5.74 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.882 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.433 ' O ' ' N ' ' B' ' 81' ' ' GLY . 6.9 mt -55.95 -33.37 64.7 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.421 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.12 -39.8 54.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.101 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.799 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.7 mp -64.36 -57.92 7.97 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.773 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.574 HG21 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -72.75 -43.77 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.137 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.69 -50.27 49.97 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.316 -0.945 . . . . 0.0 111.068 179.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -51.8 -35.45 39.06 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.394 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.555 ' CD2' ' HE1' ' B' ' 59' ' ' MET . 8.6 mt -62.29 -46.06 90.48 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.896 0.379 . . . . 0.0 110.048 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.504 ' O ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.42 -35.3 65.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.329 0.585 . . . . 0.0 110.812 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.584 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -81.08 -17.25 12.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.159 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -117.31 15.72 14.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.534 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.411 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.3 OUTLIER -160.98 -27.37 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' O ' ' B' ' 84' ' ' ALA . 14.1 m-70 -93.92 27.67 2.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.547 -0.461 . . . . 0.0 112.121 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 59.31 16.52 5.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' SER . . . . . 0.406 ' CB ' ' HA ' ' B' ' 85' ' ' VAL . 0.2 OUTLIER -72.88 -50.75 21.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.971 0.415 . . . . 0.0 109.931 179.359 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . 0.44 ' HB2' HG11 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -113.06 -38.69 4.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.789 178.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.156 179.533 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.82 -49.06 10.97 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.421 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.481 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.25 -41.56 96.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.093 0.473 . . . . 0.0 110.194 179.207 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.484 ' HA ' HD11 ' A' ' 10' ' ' ILE . 1.0 OUTLIER -51.44 -31.61 23.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -28.31 41.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.928 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.462 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 4.3 p -73.95 -40.66 62.89 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.391 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.578 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.5 mp -66.92 -56.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.902 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.506 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -52.18 -27.33 14.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.428 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.49 ' O ' HG12 ' A' ' 16' ' ' VAL . 5.9 m -72.19 -56.03 6.24 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -178.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.818 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.7 mm? -64.9 -27.5 68.9 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.626 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 12.8 mt -69.06 -37.35 76.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 CA-C-O 121.491 0.662 . . . . 0.0 110.611 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.577 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -76.49 -39.69 52.41 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 114.027 -1.442 . . . . 0.0 112.402 -176.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.818 HG21 ' O ' ' A' ' 13' ' ' LEU . 20.2 m -50.96 -33.89 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.649 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 1.3 t80 -80.55 -59.01 2.85 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.222 -1.354 . . . . 0.0 113.249 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.668 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.67 -24.73 62.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -177.4 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -51.61 62.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.817 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.554 ' HB3' ' CE2' ' A' ' 38' ' ' PHE . 7.1 m-85 -80.83 -40.89 24.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.889 0.852 . . . . 0.0 109.564 177.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.668 ' HB2' ' HA ' ' A' ' 18' ' ' GLN . . . -62.58 -12.97 26.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.285 -179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.381 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.463 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.942 0.401 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.3 p -148.23 -179.38 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.674 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -138.97 -161.12 1.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.953 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.413 ' CB ' ' HB2' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -136.66 132.37 34.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.691 0.281 . . . . 0.0 110.398 178.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -40.64 41.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.512 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.7 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.17 -41.45 61.46 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.534 179.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 2.0 mt-10 -58.91 -32.36 69.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.079 0.466 . . . . 0.0 109.782 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.553 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -69.09 -26.88 65.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.385 179.295 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.61 -59.2 5.18 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.613 0.721 . . . . 0.0 111.191 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -60.16 -45.14 94.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.204 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.554 ' CE2' ' HB3' ' A' ' 20' ' ' TYR . 2.6 m-30 -57.8 -26.71 62.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.432 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 2.7 ttm -78.24 -56.12 4.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.89 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -57.55 -19.69 27.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.025 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.454 ' CG2' ' HG2' ' A' ' 42' ' ' GLU . 10.8 t -96.68 -30.76 13.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.454 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.5 OUTLIER -127.46 -37.5 2.0 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -177.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.9 mt -106.85 35.25 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.24 0.543 . . . . 0.0 110.256 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -77.11 -28.61 54.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.745 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.15 -27.46 33.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.74 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CZ ' ' CD2' ' A' ' 88' ' ' HIS . 3.5 m-85 -86.46 -28.23 23.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.591 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 29.7 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.212 -179.806 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 53.3 t . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.871 0.367 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 59' ' ' MET . 6.6 tt -66.82 -51.96 49.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.664 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -26.85 47.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.036 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.9 -52.95 63.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.915 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.737 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 1.9 ptp -55.49 -53.54 55.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.915 0.388 . . . . 0.0 111.002 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.514 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.518 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.518 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 1.7 mm-40 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.753 0.311 . . . . 0.0 111.423 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.674 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -64.6 -133.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.509 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.7 t0 175.46 -169.51 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 118.801 0.728 . . . . 0.0 111.49 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.524 ' CG ' HG13 ' B' ' 85' ' ' VAL . 38.4 p90 -73.69 -58.86 3.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.469 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.482 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -80.05 -25.49 40.11 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.175 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HB3' ' CD1' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -44.88 -32.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.562 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 t80 -80.12 -54.07 6.11 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.572 178.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.444 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 7.1 mt -56.97 -33.52 67.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.979 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -75.09 -42.01 57.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.737 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.2 mp -65.92 -57.3 8.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.132 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.526 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.13 -44.5 64.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.948 179.316 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.444 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.73 -50.24 50.36 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.145 -1.026 . . . . 0.0 110.731 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.451 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.63 -40.1 47.28 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.362 -0.923 . . . . 0.0 111.551 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.572 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 6.9 mt -59.17 -46.36 88.6 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.892 0.377 . . . . 0.0 110.353 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.5 -33.65 63.92 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 111.291 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.522 HG13 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -82.65 -17.07 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.282 -179.476 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.78 11.86 14.65 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.878 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 18.6 t -152.75 -39.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.0 OUTLIER -89.82 -85.27 0.21 Allowed 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.82 -179.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.417 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -133.15 177.19 7.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.734 0.302 . . . . 0.0 111.079 -179.395 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 70.7 m 60.9 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.631 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 76.25 -49.45 0.59 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.247 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 35.9 t . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 121.078 0.466 . . . . 0.0 111.575 179.96 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 121.572 0.701 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.85 -49.06 11.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.415 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.48 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.22 -41.67 96.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 110.128 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.486 ' HA ' HD11 ' B' ' 10' ' ' ILE . 1.0 OUTLIER -51.47 -31.44 23.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.695 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -28.31 40.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.455 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 4.3 p -73.95 -40.64 62.91 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.421 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.577 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.5 mp -66.77 -56.31 14.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.895 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.51 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.4 OUTLIER -52.13 -27.34 13.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.512 ' O ' HG12 ' B' ' 16' ' ' VAL . 5.9 m -72.12 -56.11 6.15 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.813 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.8 mm? -64.75 -27.69 69.07 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.612 ' O ' ' HG3' ' B' ' 18' ' ' GLN . 13.0 mt -68.99 -37.42 77.2 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.78 0 CA-C-O 121.539 0.685 . . . . 0.0 110.608 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . 0.583 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -76.42 -39.66 52.92 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 113.962 -1.472 . . . . 0.0 112.442 -176.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.813 HG21 ' O ' ' B' ' 13' ' ' LEU . 20.2 m -50.91 -33.97 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 1.3 t80 -80.5 -59.06 2.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 114.207 -1.36 . . . . 0.0 113.211 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.662 ' HA ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.7 -24.73 62.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.38 -51.61 61.97 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.88 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.546 ' HB3' ' CE2' ' B' ' 38' ' ' PHE . 7.1 m-85 -80.78 -40.95 24.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.842 0.829 . . . . 0.0 109.564 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.662 ' HB2' ' HA ' ' B' ' 18' ' ' GLN . . . -62.58 -12.94 25.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.158 -1.383 . . . . 0.0 112.327 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.495 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 121.007 0.432 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.53 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 9.5 p -148.18 -179.42 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.906 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.671 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -138.95 -161.07 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.019 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' B' ' 34' ' ' GLU . 0.0 OUTLIER -136.68 132.32 34.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.783 0.325 . . . . 0.0 110.359 178.809 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.65 -40.71 40.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.951 0.405 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.702 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.06 -41.53 61.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.538 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' B' ' 38' ' ' PHE . 2.0 mt-10 -58.96 -32.36 69.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 109.786 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.554 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -69.07 -26.81 65.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.446 179.237 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.6 -59.26 5.09 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -60.04 -45.19 93.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.206 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.546 ' CE2' ' HB3' ' B' ' 20' ' ' TYR . 2.5 m-30 -57.8 -26.75 62.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.973 0.416 . . . . 0.0 110.729 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.436 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 2.7 ttm -78.22 -56.15 4.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.916 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -57.58 -19.61 26.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.071 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.45 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 10.7 t -96.73 -30.81 13.0 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.45 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.5 OUTLIER -127.38 -37.46 2.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 7.9 mt -106.93 35.41 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.268 0.556 . . . . 0.0 110.234 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -77.18 -28.6 54.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.777 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.11 -27.5 33.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.76 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.423 ' CZ ' ' CD2' ' B' ' 88' ' ' HIS . 3.5 m-85 -86.41 -28.31 23.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.659 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.7 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.142 -179.781 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 53.7 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.881 0.372 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' B' ' 59' ' ' MET . 6.6 tt -66.72 -51.98 49.74 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.662 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -26.82 47.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.069 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.83 -52.94 63.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.978 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.739 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 1.9 ptp -55.49 -53.52 55.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.027 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.514 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.567 -179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.53 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 1.7 mm-40 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.683 0.278 . . . . 0.0 111.407 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.671 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -64.46 -133.62 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.491 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 1.7 t0 175.43 -169.55 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 118.805 0.73 . . . . 0.0 111.458 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.522 ' CG ' HG13 ' A' ' 85' ' ' VAL . 38.6 p90 -73.61 -58.88 3.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.509 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -80.06 -25.5 40.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.104 179.408 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.412 ' HB3' ' CD1' ' B' ' 71' ' ' LEU . 0.2 OUTLIER -44.93 -32.63 1.68 Allowed 'General case' 0 CA--C 1.522 -0.115 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.438 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.554 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.1 t80 -80.2 -54.01 6.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.555 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.434 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 7.1 mt -56.97 -33.63 67.27 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.902 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.457 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -74.95 -42.07 58.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.257 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.739 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.2 mp -65.95 -57.2 8.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.129 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.523 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.21 -44.57 64.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.923 179.353 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.434 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.6 -50.3 49.29 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.17 -1.014 . . . . 0.0 110.761 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.45 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.63 -40.07 47.23 Favored Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.231 -0.985 . . . . 0.0 111.618 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.566 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 7.0 mt -59.16 -46.39 88.5 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.828 0.347 . . . . 0.0 110.264 178.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.479 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.44 -33.76 63.89 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.23 0.538 . . . . 0.0 111.209 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.524 HG13 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -82.64 -17.1 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.235 -179.351 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.85 11.97 14.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.863 -179.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 18.7 t -152.78 -39.46 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.103 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.479 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.0 OUTLIER -89.8 -85.24 0.21 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.856 -179.196 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . 0.42 ' O ' ' HA ' ' B' ' 85' ' ' VAL . 0.1 OUTLIER -133.04 177.22 7.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.749 0.309 . . . . 0.0 111.079 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 70.5 m 60.87 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.655 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 76.19 -49.48 0.59 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.226 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 36.0 t . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.504 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 121.288 0.566 . . . . 0.0 111.03 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.43 -44.24 8.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.321 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.509 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 19.3 m -71.63 -38.18 70.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.363 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.598 ' HA ' HD12 ' A' ' 10' ' ' ILE . 0.7 OUTLIER -52.49 -53.33 47.17 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.969 0.414 . . . . 0.0 110.445 179.772 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.08 -26.65 62.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.584 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 6' ' ' THR . 74.2 m -74.67 -54.42 7.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.569 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.598 HD12 ' HA ' ' A' ' 7' ' ' GLU . 2.2 mp -54.7 -56.5 10.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.847 0.356 . . . . 0.0 111.574 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.496 ' HA ' HD12 ' A' ' 14' ' ' ILE . 1.8 mt-10 -52.32 -27.46 15.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.847 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.54 ' O ' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -62.88 -55.72 23.59 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.196 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.946 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.1 mm? -74.79 -27.83 60.47 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.728 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 6.6 mt -67.2 -35.93 75.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 O-C-N 121.648 -0.657 . . . . 0.0 110.925 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.94 -32.7 45.6 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.455 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.946 HG21 ' O ' ' A' ' 13' ' ' LEU . 23.2 m -52.67 -35.83 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 176.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.591 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.1 t80 -78.02 -59.01 2.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.032 -1.44 . . . . 0.0 110.634 179.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.728 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 3.8 mm-40 -49.61 -45.69 48.38 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -47.91 -51.58 22.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.646 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.447 ' CZ ' ' HB2' ' A' ' 38' ' ' PHE . 3.4 m-85 -81.17 -31.89 33.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.672 0.749 . . . . 0.0 110.289 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.591 ' HB1' ' O ' ' A' ' 17' ' ' PHE . . . -86.72 20.13 2.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.0 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.303 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.612 0.244 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -140.69 153.13 45.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.137 0.494 . . . . 0.0 111.536 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.566 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -105.96 -154.17 0.51 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.956 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 t -145.25 138.05 26.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.758 0.314 . . . . 0.0 110.455 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.476 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.81 -35.85 24.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.813 -179.719 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.69 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.35 -42.85 58.68 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.441 179.484 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -55.92 -29.03 59.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 110.035 179.676 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.56 ' CD2' HD22 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -72.21 -32.56 66.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.057 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.69 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -50.02 -59.13 4.19 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.654 0.74 . . . . 0.0 110.913 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -44.27 93.87 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.7 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.447 ' HB2' ' CZ ' ' A' ' 20' ' ' TYR . 32.0 t80 -58.01 -29.64 65.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.432 ' CE ' ' CD1' ' A' ' 83' ' ' LEU . 1.1 ttm -78.08 -46.61 20.34 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.47 -19.74 63.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.028 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 t -94.35 -35.44 12.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.78 20.23 6.03 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 13.7 mt -161.84 44.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.349 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.52 -23.93 56.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.87 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.68 -14.13 62.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.229 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.45 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.2 m-85 -110.97 11.08 22.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.355 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.331 -0.211 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.584 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.469 ' CG2' ' N ' ' A' ' 56' ' ' LEU . 1.6 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.179 0.514 . . . . 0.0 110.844 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.469 ' N ' ' CG2' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -75.02 -52.01 12.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.908 -179.457 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -56.45 -29.28 61.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.264 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -52.2 66.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.252 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.738 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 2.9 ptp -54.95 -52.85 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.927 0.394 . . . . 0.0 111.175 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.5 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.286 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.534 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.878 0.371 . . . . 0.0 111.376 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.566 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -66.41 -139.02 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.255 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.511 ' C ' ' OE1' ' A' ' 75' ' ' GLU . 4.4 p-10 172.48 -157.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.347 0.521 . . . . 0.0 111.777 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.565 ' CG ' HG13 ' B' ' 85' ' ' VAL . 29.7 p90 -84.46 -59.93 2.23 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.524 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.9 tp60 -76.98 -35.13 57.42 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -177.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.611 ' N ' ' OE1' ' A' ' 75' ' ' GLU . 0.8 OUTLIER -49.22 -26.53 2.98 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.005 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.553 ' CG ' ' HB2' ' A' ' 17' ' ' PHE . 1.1 t80 -77.33 -54.05 6.94 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.506 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 8.0 mt -57.79 -33.56 68.69 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.401 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.3 OUTLIER -76.68 -43.35 38.15 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.681 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.738 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 2.7 mp -58.08 -57.57 12.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.782 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.552 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.93 -44.17 28.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.061 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.506 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.17 51.33 Favored Glycine 0 CA--C 1.508 -0.363 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.732 179.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.29 -41.13 46.89 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.147 -1.025 . . . . 0.0 111.394 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.548 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 6.6 mt -57.91 -46.8 84.42 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.623 -0.339 . . . . 0.0 110.466 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.57 -31.95 62.62 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.051 0.453 . . . . 0.0 111.058 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.565 HG13 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.17 -17.6 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.512 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.03 14.16 18.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.134 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.45 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -156.19 -37.72 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.347 179.636 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.1 t60 -91.11 157.99 16.91 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.891 0.377 . . . . 0.0 111.081 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 93.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.052 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.3 m -150.29 -67.8 0.2 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.601 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -121.05 -32.54 3.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.01 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.471 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.502 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.265 0 CA-C-O 121.36 0.6 . . . . 0.0 110.964 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.45 -44.22 8.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.376 -179.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.505 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 19.6 m -71.75 -38.03 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.35 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.606 ' HA ' HD12 ' B' ' 10' ' ' ILE . 0.7 OUTLIER -52.45 -53.36 46.52 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.915 0.388 . . . . 0.0 110.461 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.12 -26.66 62.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.574 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' B' ' 6' ' ' THR . 74.2 m -74.59 -54.41 7.52 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.604 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.606 HD12 ' HA ' ' B' ' 7' ' ' GLU . 2.2 mp -54.72 -56.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 111.615 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.489 ' HA ' HD12 ' B' ' 14' ' ' ILE . 1.8 mt-10 -52.38 -27.34 15.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.538 ' O ' HG12 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -63.02 -55.74 23.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.953 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.1 mm? -74.7 -27.83 60.56 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.731 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 6.7 mt -67.22 -35.93 75.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 121.612 -0.68 . . . . 0.0 110.859 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.09 -32.6 44.74 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.459 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.953 HG21 ' O ' ' B' ' 13' ' ' LEU . 23.2 m -52.57 -35.97 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 176.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.586 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.1 t80 -77.92 -59.03 2.95 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 113.923 -1.489 . . . . 0.0 110.683 179.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.731 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 3.8 mm-40 -49.68 -45.65 49.02 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -47.79 -51.72 21.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.614 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.456 ' CE2' ' O ' ' B' ' 34' ' ' GLU . 3.4 m-85 -81.11 -31.91 34.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.627 0.727 . . . . 0.0 110.294 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.586 ' HB1' ' O ' ' B' ' 17' ' ' PHE . . . -86.74 20.12 2.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.931 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.421 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.324 179.925 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.633 0.254 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.52 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -140.69 153.19 45.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.291 0.567 . . . . 0.0 111.417 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.564 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.0 OUTLIER -105.96 -154.19 0.51 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.956 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 13.9 t -145.28 138.03 26.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.306 . . . . 0.0 110.462 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.478 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.77 -35.92 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.776 -179.694 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.689 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.22 -42.94 58.95 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.456 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.1 OUTLIER -55.94 -28.96 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.059 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.562 ' CD2' HD22 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -72.26 -32.61 66.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.028 178.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.689 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -49.96 -59.07 4.23 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.594 0.712 . . . . 0.0 110.863 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.09 93.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.631 -178.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.445 ' HB2' ' CZ ' ' B' ' 20' ' ' TYR . 31.9 t80 -58.16 -29.65 65.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.435 ' CE ' ' CD1' ' B' ' 83' ' ' LEU . 1.1 ttm -78.03 -46.64 20.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.946 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.51 -19.63 63.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.082 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 5.9 t -94.45 -35.32 12.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' B' ' 43' ' ' LEU . 0.1 OUTLIER -128.86 20.3 5.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.804 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 13.7 mt -161.85 44.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.036 0.446 . . . . 0.0 110.413 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.44 -24.09 57.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.814 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.67 -13.98 62.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.246 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.44 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.1 m-85 -111.03 11.12 22.09 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.419 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.642 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . 0.472 ' CG2' ' N ' ' B' ' 56' ' ' LEU . 1.6 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.154 0.502 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.472 ' N ' ' CG2' ' B' ' 55' ' ' VAL . 0.1 OUTLIER -75.03 -51.91 12.39 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.944 -179.434 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -56.56 -29.27 61.81 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.282 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -52.19 66.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.245 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.733 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 2.9 ptp -54.89 -52.9 61.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 111.236 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.493 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.36 -179.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.52 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.97 0.414 . . . . 0.0 111.324 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.564 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -66.36 -139.02 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.212 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.504 ' C ' ' OE1' ' B' ' 75' ' ' GLU . 4.4 p-10 172.47 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.383 0.538 . . . . 0.0 111.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.565 ' CG ' HG13 ' A' ' 85' ' ' VAL . 29.7 p90 -84.45 -59.92 2.23 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -178.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.51 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.8 tp60 -76.94 -35.11 57.51 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.608 ' OE1' ' N ' ' B' ' 75' ' ' GLU . 0.8 OUTLIER -49.25 -26.63 3.11 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.925 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.559 ' CG ' ' HB2' ' B' ' 17' ' ' PHE . 1.1 t80 -77.25 -54.08 6.93 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.5 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 8.0 mt -57.77 -33.51 68.58 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.403 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.3 OUTLIER -76.71 -43.35 37.88 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 2.7 mp -58.2 -57.46 12.78 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.796 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.548 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.92 -44.18 28.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.09 179.406 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.5 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -50.11 51.66 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.178 -1.01 . . . . 0.0 110.747 179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.463 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.32 -41.16 47.18 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.375 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.537 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 6.4 mt -57.87 -46.85 84.23 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.47 -31.98 62.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.143 0.497 . . . . 0.0 111.205 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.565 HG13 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.15 -17.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.586 -179.469 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.96 14.01 18.37 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.162 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.44 ' HB3' ' CD2' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -156.12 -37.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.321 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.412 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.1 t60 -91.02 157.98 16.95 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.879 0.371 . . . . 0.0 111.118 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.38 93.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.975 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.6 m -150.43 -67.69 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -121.11 -32.59 3.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.96 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.53 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.184 0 CA-C-O 121.476 0.655 . . . . 0.0 111.702 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.48 -48.97 37.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.755 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.472 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.4 m -60.49 -37.57 81.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.078 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.7 -36.64 47.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.46 -26.96 41.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.342 178.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -65.37 -45.31 84.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.288 -179.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.576 ' O ' HG13 ' A' ' 14' ' ' ILE . 3.2 mp -63.05 -56.77 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.46 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.547 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.72 -179.455 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.459 ' O ' HG12 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.74 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.871 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.896 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.0 mm? -71.97 -27.22 62.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.851 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.8 mt -66.9 -36.02 76.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.944 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.75 -35.67 60.11 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.35 -1.296 . . . . 0.0 112.473 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.896 HG21 ' O ' ' A' ' 13' ' ' LEU . 19.9 m -56.82 -35.68 47.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.479 0.657 . . . . 0.0 109.742 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.621 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 14.6 t80 -80.22 -59.91 2.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.757 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.851 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.3 OUTLIER -66.51 -29.63 69.77 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.335 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.43 -51.68 52.71 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.323 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.44 ' HB3' HD22 ' A' ' 30' ' ' LEU . 2.0 m-85 -80.35 -40.03 27.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.69 0.757 . . . . 0.0 109.538 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.666 ' HB1' ' HA ' ' A' ' 18' ' ' GLN . . . -56.89 -24.47 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.608 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.443 -179.921 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.458 -0.061 0 CA-C-O 120.912 0.386 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.461 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.8 p -136.4 -177.45 4.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.71 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.445 ' HG ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -129.68 -128.24 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.632 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.97 130.47 0.79 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.407 ' N ' HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -49.75 -41.33 43.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.944 0.402 . . . . 0.0 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.682 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.33 -43.42 56.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.431 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 1.7 mt-10 -55.82 -29.15 59.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.01 0.433 . . . . 0.0 110.428 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.509 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 6.8 t80 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.371 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.76 -59.04 5.61 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.686 0.755 . . . . 0.0 111.3 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.24 -32.52 68.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.274 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -57.78 -38.18 75.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.468 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -74.61 -35.4 62.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.201 0.524 . . . . 0.0 110.338 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -73.27 -19.25 61.1 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.46 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.7 t -107.65 -43.57 4.47 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -127.85 -18.42 4.26 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -176.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 9.4 mt -120.27 49.56 1.41 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.273 0.559 . . . . 0.0 110.183 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -82.93 -29.37 29.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.926 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.75 30.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.59 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.413 ' CE1' ' HB3' ' A' ' 87' ' ' CYS . 47.8 m-85 -95.79 20.48 9.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.745 -179.934 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 59' ' ' MET . 53.9 t . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.724 0.297 . . . . 0.0 111.392 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 60' ' ' MET . 0.1 OUTLIER -76.51 -52.57 9.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.066 0.46 . . . . 0.0 112.017 -179.491 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.405 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 10.2 t0 -55.38 -59.08 5.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.196 -178.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.8 -35.59 73.09 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.706 ' SD ' ' HA ' ' A' ' 79' ' ' LEU . 3.2 tmm? -75.51 -43.78 47.18 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 120.426 0.155 . . . . 0.0 111.413 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.478 ' HG3' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.856 0.36 . . . . 0.0 110.443 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.461 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.697 0.284 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 0.5 OUTLIER -65.0 -137.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.581 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 22.9 t70 171.78 161.24 0.1 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.436 0.562 . . . . 0.0 111.492 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.53 ' CG ' HG11 ' B' ' 85' ' ' VAL . 35.9 p90 -52.14 -59.77 3.99 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.644 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.463 HE22 ' HB2' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -79.66 -22.9 42.94 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.261 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.682 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.4 tt0 -45.41 -43.68 11.45 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.51 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.6 t80 -71.32 -54.41 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.301 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.19 -38.56 52.99 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.183 0.516 . . . . 0.0 109.74 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.463 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -36.72 57.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.494 -0.776 . . . . 0.0 108.991 178.028 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.719 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -65.27 -57.54 8.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.288 -179.514 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.534 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.89 -43.84 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 178.636 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.441 ' N ' HG21 ' A' ' 80' ' ' ILE . . . -54.2 -50.99 53.68 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.65 179.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.431 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.05 -41.64 60.27 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.867 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 3.3 mt -61.86 -42.26 98.84 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.42 -32.43 57.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.374 0.607 . . . . 0.0 110.188 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.529 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.67 -17.78 9.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.553 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.87 14.5 19.81 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.143 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.413 ' HB3' ' CE1' ' A' ' 46' ' ' PHE . 52.8 t -157.94 -42.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.926 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -90.31 162.93 14.95 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.872 0.368 . . . . 0.0 110.963 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.18 112.64 1.79 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.081 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.65 -53.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -127.39 -45.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.691 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 30.8 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.916 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.46 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.37 -49.07 36.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.752 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.472 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.4 m -60.44 -37.55 81.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.089 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.46 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -36.69 48.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.008 0.432 . . . . 0.0 110.274 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -26.95 42.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.413 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -65.44 -45.3 84.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.227 -179.664 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.565 ' O ' HG13 ' B' ' 14' ' ' ILE . 3.2 mp -63.1 -56.75 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.434 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.532 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.702 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.456 ' O ' HG12 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.86 13.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.905 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.0 mm? -71.92 -27.16 62.64 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.86 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.8 mt -66.92 -36.04 76.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 O-C-N 121.751 -0.593 . . . . 0.0 110.998 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.76 60.36 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 112.474 -176.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.905 HG21 ' O ' ' B' ' 13' ' ' LEU . 20.1 m -56.85 -35.63 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.458 0.647 . . . . 0.0 109.748 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.619 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 14.8 t80 -80.16 -59.98 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.737 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.86 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.3 OUTLIER -66.44 -29.68 69.87 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.47 -51.68 52.96 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.318 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.452 ' HB3' HD22 ' B' ' 30' ' ' LEU . 2.0 m-85 -80.3 -39.99 27.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.708 0.766 . . . . 0.0 109.66 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.673 ' HB1' ' HA ' ' B' ' 18' ' ' GLN . . . -56.91 -24.41 52.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.623 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.459 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.913 0.387 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.438 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.6 p -136.4 -177.39 4.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.609 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.452 HD22 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -129.67 -128.24 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.61 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.96 130.5 0.79 Allowed 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.409 ' N ' HD22 ' B' ' 71' ' ' LEU . 0.0 OUTLIER -49.75 -41.31 43.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.017 -179.533 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.681 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.36 -43.33 57.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.997 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 1.7 mt-10 -55.99 -29.02 59.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.079 0.466 . . . . 0.0 110.425 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 6.9 t80 -72.77 -27.0 61.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.289 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.681 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.64 -59.02 5.62 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.597 0.713 . . . . 0.0 111.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.51 68.39 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.303 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.78 -38.2 75.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.472 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -74.65 -35.33 62.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.154 0.502 . . . . 0.0 110.326 179.459 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -73.28 -19.17 61.11 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.476 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 3.7 t -107.61 -43.71 4.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -127.76 -18.53 4.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 9.4 mt -120.14 49.51 1.4 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.312 0.577 . . . . 0.0 110.304 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -82.94 -29.3 29.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.919 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.74 30.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.57 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.42 ' CD1' ' HB3' ' B' ' 87' ' ' CYS . 47.4 m-85 -95.86 20.52 9.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.725 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.709 -179.915 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 54.2 t . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.7 0.286 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.407 ' CD2' ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -76.49 -52.59 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.056 0.455 . . . . 0.0 112.03 -179.532 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . 0.407 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 10.2 t0 -55.34 -59.07 5.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.273 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.8 -35.68 73.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.704 ' SD ' ' HA ' ' B' ' 79' ' ' LEU . 3.2 tmm? -75.38 -43.88 47.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.436 0.16 . . . . 0.0 111.41 -179.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.474 ' HG3' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 120.858 0.361 . . . . 0.0 110.428 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.703 0.287 . . . . 0.0 110.868 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' B' ' 72' ' ' ASP . 0.5 OUTLIER -65.1 -138.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.588 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 22.8 t70 171.78 161.3 0.1 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.453 0.569 . . . . 0.0 111.462 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.529 ' CG ' HG11 ' A' ' 85' ' ' VAL . 35.6 p90 -52.16 -59.79 3.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.626 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.456 HE22 ' HB2' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -79.69 -22.91 42.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.16 -179.32 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.677 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.4 tt0 -45.42 -43.7 11.49 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.52 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.6 t80 -71.3 -54.39 10.99 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.356 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 5.3 mt -51.21 -38.65 53.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.195 0.521 . . . . 0.0 109.667 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.456 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.37 -36.58 58.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.049 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.721 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -65.36 -57.63 7.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.264 -179.564 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.524 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.71 -43.82 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.419 178.619 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.441 ' N ' HG21 ' B' ' 80' ' ' ILE . . . -54.13 -51.0 53.35 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.141 -1.028 . . . . 0.0 110.705 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.431 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.07 -41.64 60.46 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.895 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 3.4 mt -61.91 -42.28 98.91 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.27 -32.53 56.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.53 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.621 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.01 14.58 19.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.077 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.42 ' HB3' ' CD1' ' B' ' 46' ' ' PHE . 52.9 t -158.03 -42.27 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 14.8 t-80 -90.32 162.93 14.94 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.821 0.343 . . . . 0.0 110.972 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.21 112.61 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.67 -53.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -127.54 -45.58 1.48 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.711 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.031 179.814 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.441 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 121.351 0.596 . . . . 0.0 111.156 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.96 -49.07 11.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.998 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.499 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.6 OUTLIER -62.55 -40.42 96.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.087 179.121 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.441 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.1 -36.64 41.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.633 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.67 -26.89 40.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.707 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' ' 6' ' ' THR . 1.6 p -66.86 -42.2 86.08 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.513 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.653 HG12 HD12 ' B' ' 80' ' ' ILE . 3.5 mp -70.98 -54.65 16.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.776 0.322 . . . . 0.0 111.682 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.94 -27.28 12.63 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -178.606 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.521 ' O ' HG13 ' A' ' 16' ' ' VAL . 16.6 m -75.73 -55.87 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.777 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.788 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.8 mm? -58.82 -27.06 64.72 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.85 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 8.8 mt -73.54 -38.67 52.85 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 CA-C-O 121.489 0.661 . . . . 0.0 110.357 178.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 19' ' ' LYS . . . -73.63 -37.15 65.46 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.787 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.788 HG23 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -56.81 -36.29 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-O 121.463 0.649 . . . . 0.0 109.815 178.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.595 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 4.2 t80 -79.81 -59.92 2.55 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.664 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.85 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.5 OUTLIER -64.42 -39.45 93.86 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.603 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 11.7 tppt? -47.89 -50.69 25.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.812 0.339 . . . . 0.0 110.817 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.51 ' CG ' ' CD2' ' A' ' 38' ' ' PHE . 0.8 OUTLIER -79.35 -39.83 31.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.769 0.795 . . . . 0.0 109.344 178.464 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.684 ' HB2' ' HA ' ' A' ' 18' ' ' GLN . . . -59.36 -19.02 43.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.24 -1.345 . . . . 0.0 112.063 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.627 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.433 ' O ' ' OG1' ' A' ' 29' ' ' THR . 28.5 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.789 0.328 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 28' ' ' VAL . 3.5 p 56.33 154.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.817 -0.628 . . . . 0.0 111.375 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.49 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -101.99 -128.9 0.23 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.27 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -171.81 123.79 0.53 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.413 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.68 -36.33 24.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.128 -179.244 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.652 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.21 -42.0 60.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.646 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.38 -28.59 68.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.114 0.483 . . . . 0.0 109.963 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -72.05 -31.62 66.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.958 179.166 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.652 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -50.87 -59.17 4.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.683 0.754 . . . . 0.0 111.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -55.18 28.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.446 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.51 ' CD2' ' CG ' ' A' ' 20' ' ' TYR . 21.2 m-85 -57.91 -35.6 71.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.166 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.407 ' CE ' ' CD1' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -72.61 -27.6 62.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.602 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.6 m-20 -73.71 -19.6 60.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.719 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.49 -80.74 0.58 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.669 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.39 -30.66 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.781 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.407 ' CD1' ' CE ' ' A' ' 39' ' ' MET . 30.5 mt -133.64 51.67 2.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.004 0.43 . . . . 0.0 110.761 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.78 -41.49 30.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.884 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.87 24.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.245 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -82.6 -40.53 20.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 29.9 p . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.807 179.918 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.6 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.771 0.32 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.582 ' O ' ' HG2' ' A' ' 59' ' ' MET . 10.8 tp -68.69 -45.11 72.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.557 0.694 . . . . 0.0 110.465 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.6 -26.51 44.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.846 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.14 -53.67 10.43 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.471 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.712 ' HE1' ' O ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -55.92 -53.79 52.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.004 0.431 . . . . 0.0 111.633 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.514 ' H ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.083 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 1.5 mm-40 . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 120.762 0.315 . . . . 0.0 110.488 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.458 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -70.39 -138.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.136 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.427 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 0.5 OUTLIER 172.39 179.04 0.08 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 118.516 0.598 . . . . 0.0 111.715 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.598 ' HB2' HG13 ' B' ' 85' ' ' VAL . 44.2 p90 -64.78 -57.65 8.35 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.336 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -78.81 -20.99 48.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.076 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.407 ' O ' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -45.1 -36.86 3.87 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 35' ' ' PHE . 2.9 t80 -80.2 -54.24 5.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.799 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.428 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 7.2 mt -51.83 -34.09 38.9 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.175 0.512 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.41 -48.99 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.223 178.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.712 ' O ' ' HE1' ' A' ' 59' ' ' MET . 5.3 mp -59.78 -58.19 9.65 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.868 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.634 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -71.24 -46.46 65.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.843 179.576 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.35 50.53 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.102 -1.047 . . . . 0.0 110.525 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -52.11 -32.79 36.29 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.583 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.546 ' CD2' ' HE1' ' A' ' 59' ' ' MET . 14.1 mt -64.48 -46.6 82.32 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 120.901 0.381 . . . . 0.0 110.12 179.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.463 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.09 -32.87 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.625 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.594 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.6 9.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.403 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.94 12.75 14.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.491 ' N ' ' O ' ' A' ' 83' ' ' LEU . 53.6 t -152.45 -43.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.879 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -84.11 148.82 26.59 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.75 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.36 85.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.213 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' PHE . 41.0 p -179.59 102.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.744 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CB ' ' O ' ' A' ' 90' ' ' SER . 0.5 OUTLIER 82.85 -30.13 0.09 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.8 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 -179.532 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' THR . . . . . 0.445 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.179 0 CA-C-O 121.478 0.656 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -49.11 11.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.998 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.499 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.6 OUTLIER -62.44 -40.44 96.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.025 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.445 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.16 -36.58 41.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.61 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.77 -26.88 40.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.66 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' B' ' 6' ' ' THR . 1.6 p -66.79 -42.26 86.28 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.519 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.634 HG12 HD12 ' A' ' 80' ' ' ILE . 3.5 mp -71.04 -54.63 16.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.597 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.554 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.01 -27.27 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.529 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.513 ' O ' HG13 ' B' ' 16' ' ' VAL . 16.6 m -75.67 -55.83 5.27 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.909 -0.317 . . . . 0.0 111.833 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.783 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.8 mm? -58.83 -27.17 64.85 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.856 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 8.8 mt -73.44 -38.73 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 CA-C-O 121.433 0.635 . . . . 0.0 110.34 178.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' B' ' 19' ' ' LYS . . . -73.62 -37.1 65.49 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.824 -177.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.783 HG23 ' O ' ' B' ' 13' ' ' LEU . 18.8 m -56.85 -36.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.429 0.633 . . . . 0.0 109.81 178.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.587 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 4.2 t80 -79.8 -60.03 2.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.661 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.5 OUTLIER -64.34 -39.48 93.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.602 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' B' ' 15' ' ' ALA . 11.7 tppt? -47.9 -50.68 25.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.852 0.358 . . . . 0.0 110.888 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.517 ' CG ' ' CD2' ' B' ' 38' ' ' PHE . 0.8 OUTLIER -79.25 -39.88 31.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.8 0.81 . . . . 0.0 109.335 178.404 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.668 ' HB2' ' HA ' ' B' ' 18' ' ' GLN . . . -59.45 -19.04 44.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.985 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.411 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.663 -179.927 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . 0.425 ' O ' ' OG1' ' B' ' 29' ' ' THR . 28.8 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.701 0.286 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' B' ' 28' ' ' VAL . 3.7 p 56.39 154.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.392 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.491 ' HA ' ' HA ' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -102.02 -128.91 0.23 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.255 -179.846 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -171.76 123.83 0.54 Allowed 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.413 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.64 -36.38 24.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.087 -179.207 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.653 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.16 -42.11 60.45 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.28 -28.69 68.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 109.925 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -71.95 -31.72 66.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.207 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -50.81 -59.26 4.29 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.588 0.709 . . . . 0.0 111.49 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -55.14 29.45 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.578 -1.192 . . . . 0.0 111.527 -178.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.517 ' CD2' ' CG ' ' B' ' 20' ' ' TYR . 21.1 m-85 -57.87 -35.65 71.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.146 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.4 ' CE ' ' CD1' ' B' ' 43' ' ' LEU . 0.1 OUTLIER -72.63 -27.61 62.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.541 179.597 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 25.6 m-20 -73.62 -19.7 60.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.7 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.37 -80.93 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.668 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.28 -30.6 3.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.848 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.4 ' CD1' ' CE ' ' B' ' 39' ' ' MET . 30.3 mt -133.74 51.65 2.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.813 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.74 -41.53 30.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.835 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.8 23.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -82.73 -40.52 20.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.897 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 34.1 t . . . . . 0 N--CA 1.462 0.13 0 CA-C-O 120.696 0.284 . . . . 0.0 111.409 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.574 ' O ' ' HG2' ' B' ' 59' ' ' MET . 10.7 tp -68.66 -45.11 72.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.578 0.704 . . . . 0.0 110.502 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.49 -26.6 43.56 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.856 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.21 -53.65 10.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.387 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.711 ' HE1' ' O ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -55.9 -53.79 52.51 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.018 0.437 . . . . 0.0 111.6 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.534 ' H ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.147 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.42 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 1.5 mm-40 . . . . . 0 N--CA 1.463 0.215 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.459 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -70.41 -138.16 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.209 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.428 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.5 OUTLIER 172.38 179.13 0.08 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.463 0.574 . . . . 0.0 111.746 179.723 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.594 ' HB2' HG13 ' A' ' 85' ' ' VAL . 43.9 p90 -64.75 -57.73 8.15 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.349 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -78.85 -20.91 48.47 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.027 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.409 ' O ' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -45.04 -37.01 3.82 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.765 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 3.0 t80 -80.21 -54.16 6.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.792 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.417 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 7.3 mt -51.84 -34.04 38.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.194 0.521 . . . . 0.0 109.733 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.5 -48.98 17.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.172 178.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.711 ' O ' ' HE1' ' B' ' 59' ' ' MET . 5.3 mp -59.8 -58.13 9.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.869 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.653 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -71.29 -46.42 65.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.84 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.423 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -52.78 -50.4 49.98 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.126 -1.035 . . . . 0.0 110.555 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -52.22 -32.69 36.89 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.6 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.537 ' CD2' ' HE1' ' B' ' 59' ' ' MET . 14.2 mt -64.47 -46.58 82.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.979 0.419 . . . . 0.0 110.134 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.454 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.14 -32.89 62.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.603 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.598 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.52 -17.65 9.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.497 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.92 12.94 14.84 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.67 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.494 ' N ' ' O ' ' B' ' 83' ' ' LEU . 53.6 t -152.55 -43.49 0.1 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.461 ' CG ' HD11 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -84.22 148.83 26.51 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.764 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.39 85.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' B' ' 91' ' ' PHE . 40.8 p -179.52 102.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . 0.424 ' CB ' ' O ' ' B' ' 90' ' ' SER . 0.5 OUTLIER 83.01 -30.15 0.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.765 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 60.3 t . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.915 0.388 . . . . 0.0 111.299 -179.477 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.18 0 CA-C-O 121.375 0.607 . . . . 0.0 111.149 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.02 -40.1 6.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.117 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.467 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.7 m -70.16 -37.43 75.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.233 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.66 60.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.015 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -77.4 -26.82 52.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.449 ' HA ' ' CB ' ' B' ' 12' ' ' SER . 81.8 m -72.29 -51.87 18.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.64 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -52.89 -56.24 8.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.6 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.478 ' HA ' ' CD1' ' A' ' 14' ' ' ILE . 0.3 OUTLIER -52.36 -27.51 15.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -178.846 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.448 ' CB ' ' HA ' ' B' ' 9' ' ' CYS . 0.4 OUTLIER -66.01 -55.71 15.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.977 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -71.19 -27.69 63.69 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.773 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.7 mt -67.3 -37.45 79.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.546 0.688 . . . . 0.0 110.882 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.03 -32.88 61.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.376 -176.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.977 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.1 m -52.63 -38.21 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.485 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 4.6 t80 -77.5 -58.05 3.48 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.529 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.773 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -49.13 -35.8 17.41 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.839 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.1 -52.26 59.19 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.294 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.54 ' HB3' HD23 ' A' ' 30' ' ' LEU . 2.8 m-85 -81.28 -47.36 13.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.771 0.796 . . . . 0.0 110.093 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.509 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -56.89 -21.06 26.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.867 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.401 179.904 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.987 0.423 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.9 p -133.99 172.75 12.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.297 0.57 . . . . 0.0 110.778 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -114.38 -144.76 0.39 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.421 ' N ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -160.63 138.11 9.38 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.531 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -41.53 44.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.101 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.725 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.91 -45.31 61.68 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HB3' HD22 ' A' ' 30' ' ' LEU . 3.6 mt-10 -57.57 -28.95 64.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.156 0.503 . . . . 0.0 109.97 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.451 ' CE2' ' CB ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -67.49 -32.97 74.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.805 178.709 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.725 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -51.01 -59.2 4.41 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.515 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -54.09 -48.64 70.46 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.593 -178.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.444 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 31.8 t80 -57.92 -27.42 63.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.893 0.377 . . . . 0.0 110.966 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.434 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -73.7 -58.25 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.196 -179.809 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -65.38 -19.36 65.91 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.436 ' CG2' ' HA ' ' A' ' 38' ' ' PHE . 13.3 t -96.08 -31.73 12.88 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.9 OUTLIER -129.29 14.67 6.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.826 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 39' ' ' MET . 40.2 mt -161.93 41.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 109.692 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.67 -26.24 57.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.772 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.86 -7.7 36.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.05 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -112.25 -13.84 13.42 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.621 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.465 0.294 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.36 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.916 0.389 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 59' ' ' MET . 7.0 tp -75.24 -29.54 60.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 111.703 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -76.12 -28.19 57.37 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.643 -178.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.24 -45.21 41.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.697 0.284 . . . . 0.0 111.554 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.695 ' HE3' ' O ' ' A' ' 79' ' ' LEU . 0.9 OUTLIER -54.35 -54.32 42.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 112.077 -179.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' MET . . . . . 0.681 ' H ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.517 -179.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.444 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.608 0.242 . . . . 0.0 110.768 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 72' ' ' ASP . 0.8 OUTLIER -66.43 -146.79 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.396 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.619 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 1.3 p30 170.79 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.221 0.534 . . . . 0.0 112.127 179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.473 ' CE2' ' CB ' ' B' ' 90' ' ' SER . 0.3 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.698 -178.739 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.453 HE21 ' CB ' ' A' ' 78' ' ' ASN . 37.4 tp60 -66.41 -34.01 76.99 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.603 -178.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.598 ' O ' ' CD2' ' A' ' 79' ' ' LEU . 1.9 tt0 -45.14 -47.09 12.25 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.806 0.336 . . . . 0.0 110.188 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.8 t80 -70.98 -46.45 62.31 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.412 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' GLY . 7.2 mt -56.81 -40.14 75.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.453 ' CB ' HE21 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -39.51 53.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.056 178.183 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.695 ' O ' ' HE3' ' A' ' 59' ' ' MET . 0.1 OUTLIER -60.26 -58.22 9.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.526 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.15 -46.08 45.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.706 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.452 ' N ' ' CG2' ' A' ' 80' ' ' ILE . . . -54.27 -50.33 56.49 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 178.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.471 ' HA2' HG21 ' A' ' 85' ' ' VAL . . . -51.41 -35.53 36.14 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.425 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.564 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 11.3 mt -61.5 -43.9 98.04 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.88 0.371 . . . . 0.0 110.06 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.29 -34.22 63.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.324 0.583 . . . . 0.0 110.942 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.471 HG21 ' HA2' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -84.17 -17.01 10.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.195 -179.682 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.16 13.64 15.77 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.764 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.435 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.5 OUTLIER -157.32 -42.87 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.263 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 20.4 m-70 -75.86 147.67 38.9 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.378 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.35 78.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.477 ' CB ' ' CE2' ' B' ' 73' ' ' PHE . 74.9 m -145.99 -53.55 0.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.623 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.96 -44.97 3.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.743 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 m . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.317 -179.983 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.0 111.16 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.87 -40.29 6.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.081 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.468 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.6 m -70.07 -37.47 75.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.227 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -39.67 61.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.028 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -77.44 -26.81 51.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.635 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' CYS . . . . . 0.448 ' HA ' ' CB ' ' A' ' 12' ' ' SER . 81.7 m -72.34 -51.79 19.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.146 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ILE . . . . . 0.643 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -52.89 -56.26 8.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.653 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.479 ' HA ' ' CD1' ' B' ' 14' ' ' ILE . 0.3 OUTLIER -52.34 -27.55 15.85 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.455 ' O ' HG11 ' B' ' 16' ' ' VAL . 0.4 OUTLIER -65.89 -55.66 15.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.027 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' LEU . . . . . 0.963 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -71.35 -27.65 63.51 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' ILE . . . . . 0.769 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.7 mt -67.31 -37.4 78.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.543 0.687 . . . . 0.0 110.851 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.11 -32.83 61.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.403 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.963 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.9 m -52.64 -38.31 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.498 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 4.5 t80 -77.48 -58.06 3.48 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.092 -1.413 . . . . 0.0 110.486 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.769 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -49.07 -35.85 16.94 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -52.32 58.9 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.204 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' TYR . . . . . 0.536 ' HB3' HD23 ' B' ' 30' ' ' LEU . 2.8 m-85 -81.22 -47.38 13.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.768 0.794 . . . . 0.0 110.152 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' ALA . . . . . 0.519 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -56.98 -20.92 26.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.897 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.371 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.327 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 121.033 0.444 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.9 p -133.91 172.77 12.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.294 0.569 . . . . 0.0 110.798 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . 0.536 HD23 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -114.41 -144.74 0.39 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.578 -179.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.419 ' N ' HD21 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -160.65 138.01 9.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.615 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -41.6 44.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.809 0.337 . . . . 0.0 111.045 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' THR . . . . . 0.727 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.86 -45.25 62.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.855 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . 0.452 ' HB3' HD22 ' B' ' 30' ' ' LEU . 3.6 mt-10 -57.61 -28.96 64.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.213 0.53 . . . . 0.0 109.952 179.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' PHE . . . . . 0.456 ' CE2' ' CB ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -67.43 -33.01 74.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.83 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' LEU . . . . . 0.727 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.0 -59.21 4.41 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.437 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 68.9 m -54.2 -48.61 70.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.523 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.445 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 31.9 t80 -57.88 -27.42 63.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.858 0.361 . . . . 0.0 110.92 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' MET . . . . . 0.429 ' O ' ' N ' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -73.76 -58.19 3.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.209 -179.701 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -65.5 -19.32 65.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.051 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.443 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 13.3 t -95.98 -31.73 12.93 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' GLU . . . . . 0.443 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.9 OUTLIER -129.25 14.54 6.16 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -177.775 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.429 ' N ' ' O ' ' B' ' 39' ' ' MET . 39.5 mt -161.87 41.47 0.14 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.64 -26.26 57.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.799 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.88 -7.6 36.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.036 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -112.28 -13.96 13.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.414 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 32.0 t . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.887 0.375 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.597 ' O ' ' HG3' ' B' ' 59' ' ' MET . 7.0 tp -75.36 -29.5 59.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.657 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -76.05 -28.25 57.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.666 -178.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.23 -45.19 41.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.744 0.307 . . . . 0.0 111.625 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' MET . . . . . 0.689 ' HE3' ' O ' ' B' ' 79' ' ' LEU . 0.9 OUTLIER -54.28 -54.42 40.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.169 0.509 . . . . 0.0 112.112 -179.371 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' MET . . . . . 0.666 ' H ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.548 -179.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.455 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.565 0.221 . . . . 0.0 110.786 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.62 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.8 OUTLIER -66.46 -146.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' ASP . . . . . 0.62 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 1.3 p30 170.72 -169.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.227 0.536 . . . . 0.0 112.147 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.477 ' CE2' ' CB ' ' A' ' 90' ' ' SER . 0.3 OUTLIER -70.15 -63.93 0.99 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.709 -178.785 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' GLN . . . . . 0.457 HE21 ' CB ' ' B' ' 78' ' ' ASN . 37.6 tp60 -66.35 -34.07 77.15 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.561 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . 0.591 ' O ' ' CD2' ' B' ' 79' ' ' LEU . 1.9 tt0 -45.06 -47.2 11.85 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.861 0.362 . . . . 0.0 110.095 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.516 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.9 t80 -71.01 -46.4 62.27 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.356 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' B' ' 81' ' ' GLY . 7.1 mt -56.83 -40.14 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' ASN . . . . . 0.457 ' CB ' HE21 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -39.6 53.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.208 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.689 ' O ' ' HE3' ' B' ' 59' ' ' MET . 0.1 OUTLIER -60.21 -58.23 9.39 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.559 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . 0.514 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.2 -46.09 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.655 178.865 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.447 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -54.38 -50.13 57.68 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 178.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' GLY . . . . . 0.488 ' HA2' HG21 ' B' ' 85' ' ' VAL . . . -51.55 -35.43 37.07 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.433 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.565 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 11.3 mt -61.59 -43.94 97.92 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.878 0.371 . . . . 0.0 110.003 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.12 -34.24 63.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.402 0.62 . . . . 0.0 110.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.488 HG21 ' HA2' ' B' ' 82' ' ' GLY . 0.0 OUTLIER -84.32 -16.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.126 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.1 13.59 15.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.775 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.5 OUTLIER -157.29 -42.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' HIS . . . . . 0.511 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 20.2 m-70 -75.96 147.78 38.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.96 0.41 . . . . 0.0 111.305 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.37 78.69 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' SER . . . . . 0.473 ' CB ' ' CE2' ' A' ' 73' ' ' PHE . 74.9 m -146.01 -53.57 0.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.534 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.99 -44.93 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.702 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.1 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.316 -179.995 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.773 0.32 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' A' ' 3' ' ' PRO . 18.0 mtm180 -158.18 -65.07 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.065 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' A' ' 2' ' ' ARG . 78.4 Cg_endo -76.89 4.45 5.7 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.918 2.412 . . . . 0.0 113.885 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.514 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER -68.36 137.91 54.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.477 0.656 . . . . 0.0 111.485 -179.161 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.75 -41.31 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.211 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.516 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.5 m -71.08 -39.41 72.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.227 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.514 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 1.2 mm-40 -51.92 -53.34 42.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.422 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -65.94 -26.64 67.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.184 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.461 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 0.3 OUTLIER -64.92 -49.86 68.75 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.353 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.577 HG12 HD12 ' B' ' 80' ' ' ILE . 2.8 mp -61.47 -57.16 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.744 0.307 . . . . 0.0 111.556 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.466 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -52.89 -27.42 18.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.754 -179.286 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.492 ' O ' HG11 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.85 -55.44 22.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.702 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.9 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.3 mm? -74.22 -28.61 61.33 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -178.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.787 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 6.3 mt -66.88 -37.06 78.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.336 0.589 . . . . 0.0 111.398 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.93 49.06 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.692 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.9 HG21 ' O ' ' A' ' 13' ' ' LEU . 24.3 m -52.24 -37.55 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.561 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 3.5 t80 -77.1 -57.95 3.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.277 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.3 mm-40 -48.98 -47.21 44.37 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.66 -51.8 20.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.69 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.438 ' CD1' ' HB2' ' A' ' 38' ' ' PHE . 1.5 m-85 -81.18 -29.76 34.55 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.617 0.722 . . . . 0.0 110.373 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 17' ' ' PHE . . . -84.11 12.96 5.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.281 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 139.55 122.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.749 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -96.69 -28.84 14.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.711 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -123.07 29.04 6.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.799 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.17 107.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.439 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.24 -53.3 1.11 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.954 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.1 m -154.39 -176.45 5.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.9 m -102.4 22.59 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.375 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.427 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 1.2 p -129.86 -172.17 2.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.48 ' HG ' ' CA ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -142.71 -121.77 0.09 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.868 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.31 130.96 0.6 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.419 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 20.8 mtmt -50.02 -41.39 47.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 111.088 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.413 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -55.97 -28.79 58.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.106 0.479 . . . . 0.0 110.133 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -69.63 -31.98 70.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.104 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.6 mm? -53.12 -59.07 5.01 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.756 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.1 p -59.58 -41.8 91.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.645 -1.162 . . . . 0.0 111.866 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.438 ' HB2' ' CD1' ' A' ' 20' ' ' TYR . 78.8 t80 -57.87 -46.97 84.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.87 0.367 . . . . 0.0 111.339 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.483 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -59.93 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.188 -179.549 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -73.3 -19.67 60.99 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.428 ' CG2' ' HA ' ' A' ' 38' ' ' PHE . 6.8 t -98.99 -31.07 11.99 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 1.3 mt-10 -132.39 23.82 4.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -177.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 11.8 mt -163.18 52.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.494 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 48' ' ' LYS . . . -75.27 -27.31 59.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.475 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.65 -20.03 59.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.424 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 36.7 m-85 -97.61 -30.03 13.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -131.41 44.22 2.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.57 108.79 5.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.587 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.3 t30 60.47 20.05 9.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 53.95 35.81 22.84 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -53.09 -28.74 26.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.863 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -133.97 98.71 14.23 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.619 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -83.43 20.33 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.65 2.233 . . . . 0.0 113.012 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.447 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -113.77 -11.25 13.03 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.86 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.7 t -84.54 -63.11 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.411 ' CD2' ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.3 -51.54 13.0 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.726 -179.322 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.411 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 5.0 t70 -55.28 -38.39 68.53 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.397 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -75.0 -32.89 61.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.689 0.28 . . . . 0.0 111.685 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.517 ' CG ' ' HA ' ' A' ' 79' ' ' LEU . 8.3 tmm? -73.95 -53.06 10.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.753 ' HA ' HD21 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -60.8 -30.4 70.03 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.687 -178.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' A' ' 62' ' ' LYS . 1.0 OUTLIER -78.84 -45.21 21.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.456 ' N ' ' HG3' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -80.35 -7.3 59.02 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.464 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.753 HD21 ' HA ' ' A' ' 60' ' ' MET . 4.0 pp -57.16 -18.16 14.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t0 55.29 85.99 0.06 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.853 0.359 . . . . 0.0 110.972 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.461 ' CD2' HD13 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -88.65 118.37 28.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.328 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -173.85 33.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.2 t -111.5 101.68 10.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.725 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 67.41 10.32 7.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.365 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.87 -26.05 10.51 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.228 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.451 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -110.32 -168.47 1.32 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.879 0.339 . . . . 0.0 111.483 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.439 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER -62.29 -134.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.032 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 3.0 t0 178.58 -171.15 0.12 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 118.569 0.622 . . . . 0.0 111.623 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.555 ' CG ' HG13 ' B' ' 85' ' ' VAL . 41.3 p90 -83.31 -57.75 3.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.27 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.516 ' O ' ' N ' ' A' ' 78' ' ' ASN . 47.4 tp60 -76.1 -30.71 58.38 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.78 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.69 ' O ' HD22 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -44.7 -42.32 7.51 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.427 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 1.7 t80 -70.01 -54.37 13.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.936 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.427 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 6.0 mt -53.58 -33.57 55.29 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.3 m-20 -74.68 -40.84 61.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.296 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.69 HD22 ' O ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.05 -57.81 7.7 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.573 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.64 -42.51 48.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.045 179.125 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.427 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.86 -50.94 48.23 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.185 -1.007 . . . . 0.0 111.066 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.435 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.37 -41.82 63.51 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.365 -0.922 . . . . 0.0 111.843 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 3.2 mt -61.21 -42.29 98.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.473 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -54.46 -33.19 59.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.428 0.632 . . . . 0.0 110.338 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.559 HG13 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.55 -17.77 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.466 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.59 13.68 20.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.424 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 10.9 t -154.58 -43.32 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.781 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.473 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -93.87 -164.73 1.21 Allowed 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.705 0.288 . . . . 0.0 110.917 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.421 ' O ' ' CB ' ' A' ' 90' ' ' SER . 8.5 mt-10 -58.34 -163.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.908 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.421 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER 81.62 -57.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.026 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.13 -45.16 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.788 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.427 ' O ' ' CG ' ' A' ' 93' ' ' LYS . 3.4 t -73.95 166.55 2.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.797 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.427 ' CG ' ' O ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER 48.51 28.02 1.61 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.285 -179.705 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.8 -37.69 1.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.145 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -131.76 66.5 78.12 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.075 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.486 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 47.8 Cg_exo -57.37 -46.89 24.8 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.565 2.177 . . . . 0.0 112.326 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.486 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 78.7 Cg_endo -87.5 7.99 4.46 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.594 2.196 . . . . 0.0 112.445 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -124.67 34.45 5.0 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.059 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -114.9 141.71 47.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.891 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -175.86 4.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.928 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.757 0.313 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' B' ' 3' ' ' PRO . 18.1 mtm180 -158.18 -64.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' B' ' 2' ' ' ARG . 80.2 Cg_endo -77.0 4.44 5.77 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.923 2.416 . . . . 0.0 113.874 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.514 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.2 OUTLIER -68.41 137.88 54.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.434 0.635 . . . . 0.0 111.538 -179.165 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.67 -41.3 6.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.225 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.512 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.5 m -71.13 -39.39 72.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.233 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.514 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 1.3 mm-40 -51.95 -53.35 42.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.834 0.35 . . . . 0.0 110.369 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 53.1 mtm180 -65.88 -26.65 67.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.176 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.461 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.3 OUTLIER -64.98 -49.84 68.7 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.316 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.573 HG12 HD12 ' A' ' 80' ' ' ILE . 2.8 mp -61.58 -57.07 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.702 0.287 . . . . 0.0 111.56 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.453 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -52.85 -27.5 18.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.728 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.496 ' O ' HG11 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.81 -55.51 22.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.3 mm? -74.16 -28.63 61.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.775 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 6.3 mt -66.92 -37.0 78.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 O-C-N 121.722 -0.611 . . . . 0.0 111.428 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.37 -32.98 49.21 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.823 -1.081 . . . . 0.0 112.729 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.902 HG21 ' O ' ' B' ' 13' ' ' LEU . 24.0 m -52.13 -37.62 22.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.574 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 3.5 t80 -77.03 -58.02 3.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.137 -1.392 . . . . 0.0 110.252 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.775 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.4 mm-40 -49.03 -47.2 44.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.58 -51.9 19.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.668 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.439 ' CE1' ' HB2' ' B' ' 38' ' ' PHE . 1.5 m-85 -81.1 -29.83 34.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.58 0.705 . . . . 0.0 110.45 178.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' B' ' 17' ' ' PHE . . . -84.03 12.97 5.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.628 -1.169 . . . . 0.0 112.346 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 139.55 122.27 1.95 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.734 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -96.65 -28.9 14.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.803 0.335 . . . . 0.0 110.727 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -123.02 28.9 6.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.817 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.34 107.18 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.486 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.14 -53.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.36 . . . . 0.0 110.936 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 22.0 m -154.37 -176.42 5.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 8.4 m -102.48 22.63 2.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.27 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.409 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 1.2 p -129.84 -172.07 2.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.753 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.475 ' HG ' ' CA ' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -142.83 -121.7 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.865 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -172.38 130.96 0.59 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.422 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 20.8 mtmt -49.96 -41.41 46.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.124 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.982 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.405 ' HB3' ' CD2' ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.98 -28.75 58.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.071 0.462 . . . . 0.0 110.121 179.678 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.513 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -69.66 -32.06 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.055 178.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.6 mm? -53.08 -59.03 5.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.803 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 3.1 p -59.63 -41.74 91.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.919 -178.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.439 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 78.8 t80 -57.88 -46.98 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 111.311 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.486 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -59.91 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 -179.534 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -73.33 -19.7 60.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.448 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.431 ' CG2' ' HA ' ' B' ' 38' ' ' PHE . 6.9 t -98.98 -31.08 11.99 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.416 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 1.3 mt-10 -132.32 23.84 4.46 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.486 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 11.8 mt -163.18 52.93 0.17 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.002 0.429 . . . . 0.0 110.399 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' B' ' 48' ' ' LYS . . . -75.21 -27.33 59.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.485 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.62 -19.92 59.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.598 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.418 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 37.0 m-85 -97.74 -30.11 12.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.3 t -131.35 44.43 2.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -71.72 108.81 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 4.3 t30 60.56 19.9 9.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.752 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 54.01 35.93 23.27 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -53.16 -28.74 27.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -133.93 98.71 14.29 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.653 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -83.38 20.29 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.681 2.254 . . . . 0.0 112.976 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -113.79 -11.18 13.1 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.625 -0.797 . . . . 0.0 112.889 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 32.7 t -84.53 -63.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.033 0.444 . . . . 0.0 111.47 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.32 -51.5 13.06 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.727 -179.259 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.402 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 5.0 t70 -55.36 -38.47 68.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.32 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -74.92 -32.89 61.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.731 0.3 . . . . 0.0 111.666 -179.456 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.516 ' CG ' ' HA ' ' B' ' 79' ' ' LEU . 8.3 tmm? -74.05 -52.95 11.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.76 ' HA ' HD21 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -60.81 -30.35 70.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.739 -178.668 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.46 ' HG3' ' N ' ' B' ' 62' ' ' LYS . 1.0 OUTLIER -78.9 -45.24 21.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.46 ' N ' ' HG3' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -80.23 -7.39 58.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.76 HD21 ' HA ' ' B' ' 60' ' ' MET . 4.0 pp -57.15 -18.22 14.26 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 t0 55.38 85.94 0.06 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.466 ' CD2' HD13 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -88.68 118.31 28.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.076 0.465 . . . . 0.0 111.39 -179.334 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -173.75 33.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.634 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 7.2 t -111.52 101.73 10.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.687 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 67.35 10.28 7.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.39 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.9 -26.0 10.64 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.186 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.452 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER -110.37 -168.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.909 0.355 . . . . 0.0 111.464 -179.439 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.44 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.4 OUTLIER -62.36 -134.97 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.95 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.44 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 3.1 t0 178.64 -171.12 0.12 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.494 0.588 . . . . 0.0 111.532 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.559 ' CG ' HG13 ' A' ' 85' ' ' VAL . 41.6 p90 -83.2 -57.8 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.274 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.479 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 47.4 tp60 -76.1 -30.68 58.35 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.761 -179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.685 ' O ' HD22 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -44.75 -42.34 7.63 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.513 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.7 t80 -70.0 -54.28 13.9 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.983 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.426 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 6.0 mt -53.58 -33.6 55.39 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.3 m-20 -74.76 -40.7 61.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.312 178.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.685 HD22 ' O ' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -65.06 -57.84 7.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.434 -179.388 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.577 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.73 -42.39 47.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.082 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.426 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.98 -50.89 49.18 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.06 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.446 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.34 -41.86 63.27 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.787 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 3.2 mt -61.2 -42.23 98.23 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.921 0.391 . . . . 0.0 110.135 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.47 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -54.57 -33.13 59.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.414 0.626 . . . . 0.0 110.327 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.555 HG13 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.373 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.71 13.78 19.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.112 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.418 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 10.9 t -154.65 -43.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.841 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.47 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -94.09 -164.78 1.21 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.784 0.326 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' B' ' 90' ' ' SER . 8.7 mt-10 -58.34 -163.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.887 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' SER . . . . . 0.427 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 0.4 OUTLIER 81.61 -57.42 0.25 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.012 -179.799 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.11 -45.19 2.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.888 0.375 . . . . 0.0 110.829 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.426 ' O ' ' CG ' ' B' ' 93' ' ' LYS . 3.4 t -73.87 166.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.426 ' CG ' ' O ' ' B' ' 92' ' ' VAL . 0.1 OUTLIER 48.53 27.94 1.59 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.291 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.78 -37.65 1.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.205 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -131.76 66.47 78.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.491 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 47.9 Cg_exo -57.35 -46.96 24.41 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.579 2.186 . . . . 0.0 112.369 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.491 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 75.8 Cg_endo -87.38 8.02 4.48 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.635 2.224 . . . . 0.0 112.562 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -124.71 34.29 5.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.087 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -114.78 141.81 47.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.882 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 -175.87 4.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.205 -0.903 . . . . 0.0 110.924 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.441 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -95.72 -53.05 0.23 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.124 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 31.4 Cg_exo -63.53 -127.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.895 2.397 . . . . 0.0 111.842 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.417 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -144.48 145.23 31.76 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.307 0.575 . . . . 0.0 111.076 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.87 -44.58 9.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.322 -0.853 . . . . 0.0 111.056 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.495 ' O ' ' SG ' ' A' ' 9' ' ' CYS . 0.2 OUTLIER -65.2 -40.45 94.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.914 178.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.417 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -50.98 -36.05 37.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.575 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.73 -26.89 40.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.582 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 6' ' ' THR . 1.7 p -68.07 -41.95 81.15 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.639 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.641 ' O ' HG13 ' A' ' 14' ' ' ILE . 3.4 mp -72.09 -54.51 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.53 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.66 -27.35 11.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.541 ' O ' HG12 ' A' ' 16' ' ' VAL . 52.2 m -77.59 -56.03 4.87 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.771 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.636 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.7 mm? -57.95 -27.85 63.78 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.968 0.413 . . . . 0.0 111.778 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.641 HG13 ' O ' ' A' ' 10' ' ' ILE . 13.4 mt -71.81 -39.57 68.2 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-O 121.573 0.701 . . . . 0.0 110.512 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.572 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -77.47 -38.26 49.62 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.935 -1.484 . . . . 0.0 112.084 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 13' ' ' LEU . 25.6 m -52.6 -33.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.697 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.6 t80 -80.51 -58.48 3.1 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.943 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.645 ' HA ' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.47 -27.53 64.3 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.899 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -50.28 72.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.202 0.525 . . . . 0.0 109.685 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.529 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 3.1 m-85 -79.44 -28.47 41.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.479 178.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.697 ' HB1' ' O ' ' A' ' 17' ' ' PHE . . . -80.36 2.19 25.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.016 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.08 141.85 11.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.633 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.57 -32.13 6.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 110.835 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.84 124.89 45.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.1 -30.17 10.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.525 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.5 m80 61.36 112.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 0.0 110.877 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.401 ' O ' ' CB ' ' A' ' 28' ' ' VAL . 8.5 m -109.72 -28.46 8.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.078 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.401 ' CB ' ' O ' ' A' ' 27' ' ' SER . 4.8 t 81.64 -6.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.824 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -139.29 -179.8 6.08 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.813 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.618 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.3 0.19 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.435 -179.698 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.522 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 28.8 t -173.63 126.71 0.4 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.121 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.82 -36.34 26.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.422 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.09 -43.08 58.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.072 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.522 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.24 59.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 110.154 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.559 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -72.92 -29.45 63.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.908 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -59.13 -59.24 5.78 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.545 0.688 . . . . 0.0 111.507 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.7 t -68.03 -50.41 55.53 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.464 -178.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.529 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.8 m-85 -57.93 -25.89 61.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.228 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.443 ' HE1' ' CE1' ' A' ' 35' ' ' PHE . 1.5 ttm -78.17 -53.66 7.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.056 0.455 . . . . 0.0 110.531 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -57.84 -19.69 30.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.095 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.436 ' CG2' ' HG2' ' A' ' 42' ' ' GLU . 9.2 t -96.87 -30.28 13.23 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.3 OUTLIER -125.94 -42.18 1.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' A' ' 39' ' ' MET . 7.4 mt -101.88 34.94 2.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.315 0.579 . . . . 0.0 110.162 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.16 -28.84 34.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.924 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.55 -25.54 17.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' ' CE1' ' A' ' 88' ' ' HIS . 4.5 m-85 -102.32 17.05 24.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.088 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t -178.45 45.67 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.901 0.382 . . . . 0.0 110.992 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.04 -37.52 3.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.79 28.8 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.824 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -78.92 -22.34 45.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 tttm 65.3 30.95 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.708 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -131.85 83.18 57.93 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -61.55 -16.31 47.09 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.633 2.222 . . . . 0.0 112.348 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.43 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -71.94 -14.27 75.9 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.793 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.7 t -84.2 -59.48 2.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.56 -50.94 63.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.663 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -57.01 -26.69 60.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.064 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.53 -50.05 75.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.827 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.544 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 1.3 ptp -56.36 -53.5 56.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.062 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.526 ' N ' ' CG ' ' A' ' 59' ' ' MET . 3.6 mmt -64.33 -22.75 67.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.891 -179.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.5 mmmt -78.46 -61.66 1.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.919 0.39 . . . . 0.0 110.685 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 6.09 15.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.068 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.473 ' HB3' ' O ' ' A' ' 59' ' ' MET . 1.3 pt? -50.41 -24.76 3.27 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.15 64.18 0.29 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.973 0.416 . . . . 0.0 110.735 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' CD2' ' HG ' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -121.85 156.54 33.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -156.23 -74.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.889 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.7 p -167.04 130.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 99.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.805 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 159.94 -29.45 0.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.471 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.413 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER 60.16 -167.78 0.17 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.626 0.25 . . . . 0.0 110.846 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -63.27 -135.41 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.485 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER 172.79 -168.7 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.761 0.71 . . . . 0.0 111.753 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.52 ' CG ' HG12 ' B' ' 85' ' ' VAL . 31.8 p90 -76.21 -60.71 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.612 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.496 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.32 -25.61 39.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.438 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.4 OUTLIER -46.4 -31.77 2.84 Favored 'General case' 0 CA--C 1.522 -0.124 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.683 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.559 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 2.5 t80 -80.33 -54.35 5.8 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.856 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.449 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 7.3 mt -55.95 -33.52 64.81 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.726 179.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.432 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -75.85 -37.46 58.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.544 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.1 mp -66.08 -58.19 6.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.023 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.628 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.08 -44.77 49.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.562 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.449 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.82 -49.31 54.79 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.448 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.58 -43.59 53.2 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.363 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 6.4 mt -56.85 -44.84 82.53 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 110.018 178.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.473 ' O ' ' N ' ' A' ' 89' ' ' GLU . . . -55.47 -41.62 73.21 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.186 0.517 . . . . 0.0 110.913 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.665 ' HA ' ' HB2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -73.74 -17.11 17.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.285 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -109.11 16.37 22.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.565 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 44.8 t -158.38 -35.88 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.514 ' HB3' HD11 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -118.35 -67.87 0.96 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.665 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 2.1 mm-40 -36.55 156.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.128 0.49 . . . . 0.0 112.234 -178.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.19 66.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.146 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.41 -48.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.718 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.87 -24.99 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.135 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -78.64 -20.9 49.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.56 27.98 3.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.821 0.343 . . . . 0.0 111.333 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.422 ' N ' ' CD ' ' A' ' 96' ' ' PRO . . . -88.02 -51.48 0.4 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.126 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.512 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 54.4 Cg_exo -54.14 -46.81 30.76 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.718 2.279 . . . . 0.0 112.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 62.6 Cg_endo -73.6 -33.97 6.13 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.091 1.86 . . . . 0.0 112.377 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.14 135.91 38.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.823 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -113.42 125.54 54.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.952 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.6 -45.02 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.915 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.735 0.303 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.438 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 0.0 OUTLIER -95.78 -52.99 0.23 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.098 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 31.5 Cg_exo -63.5 -127.25 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 122.926 2.417 . . . . 0.0 111.873 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -144.55 145.29 31.75 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.363 0.601 . . . . 0.0 110.966 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.83 -44.66 9.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.502 ' O ' ' SG ' ' B' ' 9' ' ' CYS . 0.2 OUTLIER -65.21 -40.43 94.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.824 178.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.05 -36.14 38.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.47 -179.826 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.71 -26.82 40.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.636 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' B' ' 6' ' ' THR . 1.6 p -67.93 -42.15 81.48 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.641 ' O ' HG13 ' B' ' 14' ' ' ILE . 3.4 mp -71.93 -54.52 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.629 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.445 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.76 -27.23 11.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.545 ' O ' HG12 ' B' ' 16' ' ' VAL . 52.2 m -77.69 -56.0 4.88 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.819 -0.352 . . . . 0.0 111.755 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.645 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.7 mm? -57.9 -27.8 63.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.991 0.424 . . . . 0.0 111.796 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.641 HG13 ' O ' ' B' ' 10' ' ' ILE . 13.7 mt -71.96 -39.58 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 CA-C-O 121.481 0.658 . . . . 0.0 110.417 178.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . 0.582 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -77.42 -38.31 49.91 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.967 -1.47 . . . . 0.0 112.105 -176.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 13' ' ' LEU . 25.3 m -52.56 -33.61 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.702 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.6 t80 -80.4 -58.66 3.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.436 -1.256 . . . . 0.0 112.897 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.672 ' HA ' ' HB1' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.38 -27.54 64.4 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -50.3 72.12 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.522 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 3.1 m-85 -79.35 -28.55 42.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.515 178.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.702 ' HB1' ' O ' ' B' ' 17' ' ' PHE . . . -80.4 2.41 25.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.103 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 92.91 141.89 11.06 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.71 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.51 -32.19 6.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.811 0.338 . . . . 0.0 110.895 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.82 125.02 45.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.09 -30.2 10.88 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.508 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 6.5 m80 61.27 112.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.859 0.361 . . . . 0.0 110.937 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' SER . . . . . 0.404 ' O ' ' CB ' ' B' ' 28' ' ' VAL . 8.3 m -109.65 -28.5 8.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.051 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . 0.404 ' CB ' ' O ' ' B' ' 27' ' ' SER . 4.8 t 81.58 -6.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.802 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 3.0 p -139.33 -179.91 6.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.967 0.413 . . . . 0.0 110.773 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.611 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.21 0.19 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.503 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 28.7 t -173.7 126.56 0.39 Allowed 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.812 0.339 . . . . 0.0 110.092 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.406 ' N ' HD23 ' B' ' 71' ' ' LEU . 0.4 OUTLIER -49.68 -36.43 25.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.459 -179.174 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.642 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.07 -43.06 59.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.061 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.503 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.25 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.98 0.419 . . . . 0.0 110.094 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.545 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -72.91 -29.43 63.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.941 179.073 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.642 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -59.19 -59.16 5.91 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.562 0.696 . . . . 0.0 111.565 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 33.6 t -67.95 -50.42 55.98 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.528 -178.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.522 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.9 m-85 -57.99 -25.96 61.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.129 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.435 ' HE1' ' CE1' ' B' ' 35' ' ' PHE . 1.5 ttm -78.16 -53.61 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.047 0.451 . . . . 0.0 110.541 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -57.84 -19.65 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.149 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.44 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 9.2 t -96.83 -30.32 13.23 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.44 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.4 OUTLIER -125.9 -42.15 1.92 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.572 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.408 ' N ' ' O ' ' B' ' 39' ' ' MET . 7.4 mt -101.89 34.99 2.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.291 0.567 . . . . 0.0 110.053 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.27 -28.77 34.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.903 -179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.62 -25.51 17.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.801 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.421 ' CZ ' ' CE1' ' B' ' 88' ' ' HIS . 4.5 m-85 -102.29 16.96 24.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.08 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t -178.3 45.62 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.864 0.364 . . . . 0.0 111.003 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.03 -37.56 3.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.028 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.71 28.71 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -78.88 -22.42 45.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 tttm 65.33 30.9 10.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.783 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -131.8 83.15 58.21 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.879 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.32 -16.51 47.35 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.742 2.295 . . . . 0.0 112.379 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.428 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -71.91 -14.22 75.82 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.845 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.0 t -84.21 -59.49 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 111.215 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.51 -51.06 62.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -56.93 -26.76 60.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.063 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -58.52 -50.0 75.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.818 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.538 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 1.3 ptp -56.34 -53.53 56.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.086 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.529 ' N ' ' CG ' ' B' ' 59' ' ' MET . 3.6 mmt -64.22 -22.86 67.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.879 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 7.5 mmmt -78.44 -61.77 1.9 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 6.01 15.09 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.092 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.462 ' HB3' ' O ' ' B' ' 59' ' ' MET . 1.3 pt? -50.32 -24.77 3.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.12 64.21 0.29 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.413 ' CD2' ' HG ' ' B' ' 63' ' ' LEU . 0.5 OUTLIER -121.84 156.61 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.719 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -156.27 -74.26 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.932 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 7.5 p -167.02 130.72 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.833 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 99.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 159.89 -29.42 0.37 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.458 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.403 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER 60.25 -167.71 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.517 0.199 . . . . 0.0 110.864 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.486 ' O ' ' HB2' ' B' ' 72' ' ' ASP . 0.2 OUTLIER -63.39 -135.42 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.484 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.486 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 0.8 OUTLIER 172.91 -168.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.819 0.736 . . . . 0.0 111.756 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.52 ' CG ' HG12 ' A' ' 85' ' ' VAL . 31.8 p90 -76.31 -60.62 2.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.568 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.507 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.38 -25.53 39.08 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.441 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.4 OUTLIER -46.46 -31.75 2.88 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.545 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 2.5 t80 -80.29 -54.45 5.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.805 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.445 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 7.2 mt -55.93 -33.54 64.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.68 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.411 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.2 OUTLIER -75.82 -37.43 59.09 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.538 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.1 mp -66.06 -58.2 6.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.111 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.612 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.1 -44.77 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.54 179.047 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.445 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.8 -49.3 54.7 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 178.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.441 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.44 -43.62 52.34 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.44 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 6.4 mt -56.86 -44.85 82.58 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 110.025 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' GLU . . . -55.45 -41.66 73.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.205 0.526 . . . . 0.0 110.897 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.664 ' HA ' ' HB2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -73.69 -17.27 17.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.209 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -108.95 16.37 22.7 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.54 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 44.6 t -158.38 -35.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.528 ' HB3' HD11 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -118.29 -67.79 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.664 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 2.1 mm-40 -36.52 156.47 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.14 66.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.159 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.49 -49.01 0.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.723 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -68.81 -25.0 29.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -78.69 -20.83 49.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.171 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.57 27.92 3.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.795 0.331 . . . . 0.0 111.319 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.423 ' N ' ' CD ' ' B' ' 96' ' ' PRO . . . -88.05 -51.32 0.4 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.517 ' N ' ' HD2' ' B' ' 97' ' ' PRO . 55.3 Cg_exo -54.27 -46.7 31.57 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.736 2.29 . . . . 0.0 112.852 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.517 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 62.4 Cg_endo -73.65 -34.09 5.93 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.167 1.911 . . . . 0.0 112.367 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.12 135.83 38.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.793 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -113.31 125.55 54.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.61 -45.0 1.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.917 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.889 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.863 0.363 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 61.1 103.79 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.831 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -61.14 -124.68 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.909 2.406 . . . . 0.0 111.869 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.414 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -170.96 144.05 2.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.34 0.59 . . . . 0.0 111.254 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.91 -41.78 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.97 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.473 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.5 OUTLIER -67.94 -38.75 83.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.048 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.414 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.4 -33.46 30.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.437 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -27.11 41.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.562 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 1.4 p -69.07 -45.16 71.03 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.615 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -65.98 -56.37 15.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.49 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.578 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.17 -27.27 13.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.674 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.487 ' HB3' ' HB2' ' B' ' 9' ' ' CYS . 0.3 OUTLIER -69.84 -55.52 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.82 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.856 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 8.3 mt -69.47 -35.45 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-O 121.216 0.531 . . . . 0.0 110.778 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.37 51.21 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.538 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.82 HG22 ' O ' ' A' ' 13' ' ' LEU . 29.6 m -63.53 -37.11 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.167 0.508 . . . . 0.0 109.943 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.553 ' N ' HG21 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -80.53 -60.1 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.847 -178.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -58.18 -26.66 63.04 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.36 -52.16 48.12 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.306 -0.557 . . . . 0.0 109.708 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.436 ' CE2' ' O ' ' A' ' 34' ' ' GLU . 2.9 m-85 -80.53 -29.77 37.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.62 0.724 . . . . 0.0 109.235 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.581 ' HA ' HD22 ' A' ' 30' ' ' LEU . . . -83.3 20.08 1.38 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.523 -1.217 . . . . 0.0 112.218 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.18 124.4 2.14 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.501 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -114.93 30.55 7.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.779 0.323 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -136.21 -50.42 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.954 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.66 71.47 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.526 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -148.59 97.26 2.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.83 0.347 . . . . 0.0 110.826 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.5 m 62.24 147.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.945 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m -104.27 37.62 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.55 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 5.9 p -146.11 158.76 43.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.09 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.587 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -117.39 -156.16 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.893 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.88 136.45 37.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -49.86 -39.78 40.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.688 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.634 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.31 -44.58 51.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.28 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.436 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 1.3 tt0 -59.81 -29.14 68.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 0.0 109.941 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.558 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -75.59 -26.61 58.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.552 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.634 ' HB2' ' O ' ' A' ' 33' ' ' THR . 2.4 mm? -51.35 -59.26 4.42 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.686 0.755 . . . . 0.0 110.647 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.15 69.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.477 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 12.5 t80 -57.84 -28.98 64.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.402 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.448 ' CE ' ' CD1' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -78.0 -35.94 49.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.055 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -73.21 -19.78 61.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.212 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.78 -78.57 0.59 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.139 0.495 . . . . 0.0 111.606 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 1.9 mm-40 -51.36 -28.41 12.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.032 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.3 mt -134.57 51.48 2.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 110.478 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.75 -25.39 53.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.946 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.86 -14.52 63.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.134 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.42 -21.54 15.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.26 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -108.0 -21.14 12.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.377 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.405 ' O ' ' CB ' ' A' ' 49' ' ' ASN . 18.1 mttm -55.13 135.4 49.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.131 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.405 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.7 OUTLIER 80.41 -43.14 0.23 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.52 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 69.8 30.71 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.882 0.373 . . . . 0.0 110.78 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -27.58 63.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.37 75.4 0.37 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.802 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.5 87.99 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.556 2.171 . . . . 0.0 112.234 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.55 -39.14 0.16 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.41 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t -51.78 -63.03 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.898 0.38 . . . . 0.0 111.386 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -51.1 70.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.756 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.82 -30.89 62.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.372 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -42.75 92.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.008 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.523 ' CG ' ' N ' ' A' ' 60' ' ' MET . 0.4 OUTLIER -63.43 -53.54 50.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.339 -179.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.523 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -60.56 -29.75 69.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.298 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -59.55 2.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.893 0.378 . . . . 0.0 110.792 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 6.13 13.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.875 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.419 ' HG ' ' HG ' ' A' ' 65' ' ' LEU . 1.8 pt? -44.85 -33.26 1.87 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.985 0.422 . . . . 0.0 111.516 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.5 t70 43.91 82.7 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.9 179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.419 ' HG ' ' HG ' ' A' ' 63' ' ' LEU . 38.2 mt -88.48 107.24 18.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.89 0.376 . . . . 0.0 110.663 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -94.59 -33.96 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.015 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.01 -175.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.855 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.36 -23.93 26.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.092 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 155.83 -24.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.55 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 -69.73 173.33 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.062 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.587 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -65.9 -136.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.443 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.03 -164.9 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.602 0.637 . . . . 0.0 111.603 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.584 ' HB2' HG13 ' B' ' 85' ' ' VAL . 43.3 p90 -81.71 -57.2 3.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.357 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.492 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 44.6 tp60 -80.35 -27.91 38.2 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.325 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.78 -36.59 3.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.603 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 2.0 t80 -80.38 -54.24 5.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.036 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 81' ' ' GLY . 5.5 mt -50.12 -34.55 22.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.492 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.84 -38.46 53.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.603 ' HB2' ' HA ' ' A' ' 76' ' ' PHE . 1.8 mp -63.82 -58.15 7.7 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.798 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.545 ' HA ' ' HG ' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -72.6 -42.37 63.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.174 178.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.92 51.81 Favored Glycine 0 CA--C 1.507 -0.446 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.479 ' O ' HG22 ' A' ' 85' ' ' VAL . . . -51.54 -40.26 46.91 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.426 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HG ' ' HA ' ' A' ' 80' ' ' ILE . 6.3 mt -60.26 -45.53 92.95 Favored 'General case' 0 C--O 1.23 0.056 0 O-C-N 122.571 -0.37 . . . . 0.0 110.327 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.44 -30.76 61.11 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.175 0.512 . . . . 0.0 110.843 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.6 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.99 -17.48 9.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.168 -179.657 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.31 12.83 17.7 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.199 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.14 -37.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.506 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.466 ' CG ' HD13 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -89.37 -171.08 3.09 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.913 0.387 . . . . 0.0 111.3 -179.686 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.61 55.18 3.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.4 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.458 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.6 OUTLIER -117.57 -47.68 2.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.953 0.406 . . . . 0.0 110.412 179.377 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.493 ' O ' HG22 ' A' ' 92' ' ' VAL . 0.7 OUTLIER -135.37 -81.55 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.423 179.289 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 91' ' ' PHE . 7.2 m 45.15 18.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 179.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 92' ' ' VAL . 0.0 OUTLIER 61.57 23.03 13.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.998 0.428 . . . . 0.0 110.942 -179.536 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 52.94 68.44 0.84 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.012 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.503 ' N ' ' HD3' ' A' ' 96' ' ' PRO . . . -139.03 57.03 10.01 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.545 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.503 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 32.2 Cg_exo -59.84 -48.16 13.49 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.44 2.094 . . . . 0.0 112.638 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.493 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 62.8 Cg_endo -90.52 29.46 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.77 2.313 . . . . 0.0 112.769 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.33 -26.98 15.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.196 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -58.52 -51.79 68.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.012 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.23 29.79 0.89 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.869 0.366 . . . . 0.0 111.413 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.872 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.824 0.345 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 61.11 103.67 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -60.99 -124.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.909 2.406 . . . . 0.0 111.893 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.416 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -170.97 144.1 2.1 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.342 0.592 . . . . 0.0 111.25 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -41.76 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.953 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.482 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.5 OUTLIER -68.0 -38.71 82.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.029 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.416 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.31 -33.56 29.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.469 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.59 -27.17 41.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.519 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 1.4 p -69.08 -45.1 71.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.211 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.618 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -66.09 -56.31 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.404 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.563 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.24 -27.21 13.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.679 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.496 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -69.9 -55.56 9.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.32 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.809 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -68.51 -27.25 65.95 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.855 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 8.3 mt -69.42 -35.47 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-O 121.217 0.532 . . . . 0.0 110.832 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.38 51.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.408 -1.269 . . . . 0.0 112.613 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.809 HG22 ' O ' ' B' ' 13' ' ' LEU . 29.3 m -63.46 -37.2 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 109.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.548 ' N ' HG21 ' B' ' 16' ' ' VAL . 0.0 OUTLIER -80.48 -60.02 2.48 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.881 -178.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.855 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.1 OUTLIER -58.19 -26.75 63.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.28 -52.08 48.29 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.737 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.441 ' CE2' ' O ' ' B' ' 34' ' ' GLU . 2.8 m-85 -80.64 -29.8 36.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.656 0.741 . . . . 0.0 109.215 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.562 ' HA ' HD22 ' B' ' 30' ' ' LEU . . . -83.3 20.13 1.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.172 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.14 124.32 2.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.533 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -114.83 30.49 7.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 110.81 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -136.24 -50.41 0.69 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.926 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.72 71.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.591 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -148.6 97.17 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.734 0.302 . . . . 0.0 110.885 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m 62.39 147.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m -104.2 37.62 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.969 0.414 . . . . 0.0 111.138 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.532 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 5.8 p -146.19 158.75 43.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.034 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.592 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.0 OUTLIER -117.43 -156.14 0.62 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.88 179.598 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -137.89 136.41 37.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.947 0.403 . . . . 0.0 110.545 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 21.5 mtmt -49.87 -39.75 40.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.673 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.637 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.29 -44.67 51.75 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.27 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.441 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 1.3 tt0 -59.88 -28.98 68.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.223 0.535 . . . . 0.0 109.987 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.556 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -75.6 -26.61 57.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.58 179.415 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.637 ' HB2' ' O ' ' B' ' 33' ' ' THR . 2.4 mm? -51.49 -59.21 4.51 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.709 0.766 . . . . 0.0 110.571 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.17 69.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.422 -1.263 . . . . 0.0 110.407 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.466 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 12.6 t80 -57.92 -28.86 64.65 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.389 179.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.439 ' CE ' ' CD1' ' B' ' 83' ' ' LEU . 0.0 OUTLIER -78.14 -35.84 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.942 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -73.26 -19.79 60.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.178 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.81 -78.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 111.602 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.466 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 1.9 mm-40 -51.34 -28.39 12.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.082 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 38.7 mt -134.64 51.56 2.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.033 0.444 . . . . 0.0 110.482 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.83 -25.35 53.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.932 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.78 -14.52 63.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.174 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.45 -21.5 15.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.2 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -108.03 -21.18 12.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.412 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' B' ' 49' ' ' ASN . 18.0 mttm -55.09 135.4 49.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.174 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.402 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER 80.45 -43.28 0.23 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.465 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 69.91 30.68 3.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.844 0.354 . . . . 0.0 110.758 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -27.66 64.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.866 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.33 75.3 0.36 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.779 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -68.47 87.96 0.41 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.524 2.149 . . . . 0.0 112.324 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.55 -39.16 0.16 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.418 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 22.6 t -51.77 -63.08 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.893 0.377 . . . . 0.0 111.391 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -50.97 70.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.85 -30.91 62.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.347 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -42.79 92.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.528 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 0.4 OUTLIER -63.48 -53.51 51.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.32 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.52 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -60.59 -29.73 69.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.299 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 -59.52 2.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 0.0 110.83 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.46 6.17 13.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.832 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.412 ' HG ' ' HG ' ' B' ' 65' ' ' LEU . 1.8 pt? -44.83 -33.24 1.85 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 111.574 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 36.5 t70 43.87 82.67 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.913 179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.412 ' HG ' ' HG ' ' B' ' 63' ' ' LEU . 38.3 mt -88.44 107.27 18.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.926 0.393 . . . . 0.0 110.706 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -94.59 -33.99 12.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.02 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -175.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -23.93 28.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.09 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 155.92 -24.56 0.55 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.565 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.532 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 -69.66 173.3 6.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.592 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.4 OUTLIER -65.83 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.419 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 172.01 -164.89 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.574 0.625 . . . . 0.0 111.613 179.512 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.6 ' HB2' HG13 ' A' ' 85' ' ' VAL . 43.4 p90 -81.73 -57.16 3.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.384 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.488 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 44.7 tp60 -80.38 -27.8 38.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.348 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.94 -36.52 3.41 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.595 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 2.0 t80 -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.077 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.434 ' O ' ' N ' ' B' ' 81' ' ' GLY . 5.5 mt -50.17 -34.53 22.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.488 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.86 -38.58 53.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.536 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' B' ' 76' ' ' PHE . 1.8 mp -63.77 -58.24 7.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.713 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.526 ' HA ' ' HG ' ' B' ' 83' ' ' LEU . 0.0 OUTLIER -72.66 -42.33 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.15 178.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.68 -50.04 50.83 Favored Glycine 0 CA--C 1.507 -0.461 0 N-CA-C 109.989 -1.245 . . . . 0.0 109.989 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.479 ' O ' HG22 ' B' ' 85' ' ' VAL . . . -51.38 -40.39 45.95 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.403 -0.903 . . . . 0.0 111.446 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.526 ' HG ' ' HA ' ' B' ' 80' ' ' ILE . 6.1 mt -60.17 -45.63 92.45 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.332 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.443 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.36 -30.8 61.01 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.281 0.562 . . . . 0.0 110.891 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.584 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.04 -17.34 9.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.227 -179.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.35 12.79 17.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.194 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.16 -37.24 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.459 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.474 ' CG ' HD13 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -89.3 -171.07 3.1 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.838 0.351 . . . . 0.0 111.356 -179.727 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.57 55.16 3.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.447 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' SER . . . . . 0.454 ' HB3' HG11 ' B' ' 85' ' ' VAL . 0.6 OUTLIER -117.6 -47.59 2.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.406 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . 0.492 ' O ' HG22 ' B' ' 92' ' ' VAL . 0.7 OUTLIER -135.43 -81.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.412 179.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.493 ' O ' ' HG2' ' B' ' 93' ' ' LYS . 7.2 m 45.07 18.57 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' B' ' 92' ' ' VAL . 0.0 OUTLIER 61.68 23.04 13.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.893 0.378 . . . . 0.0 110.815 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . 53.01 68.35 0.85 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.999 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.495 ' N ' ' HD3' ' B' ' 96' ' ' PRO . . . -138.99 57.08 10.18 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.559 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.502 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 32.1 Cg_exo -59.82 -48.15 13.58 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.668 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 62.6 Cg_endo -90.55 29.39 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.766 2.311 . . . . 0.0 112.78 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.16 -27.05 15.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.19 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -58.46 -51.83 68.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.034 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.32 29.71 0.9 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.372 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.848 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.774 0.321 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.413 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 0.3 OUTLIER 179.79 -51.33 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.039 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 23.9 Cg_exo -68.49 -132.65 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 123.006 2.471 . . . . 0.0 111.953 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.442 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 175.32 150.78 0.11 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.389 0.614 . . . . 0.0 110.985 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.8 -49.23 10.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.442 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.473 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 3.9 m -64.12 -32.44 74.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.482 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.453 ' HA ' HD12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -52.13 -40.65 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.34 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' O ' ' OG ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -74.79 -26.86 60.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.372 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.7 m -68.14 -53.9 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.511 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.506 HG12 ' CD1' ' B' ' 80' ' ' ILE . 1.8 mp -50.77 -56.36 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.837 0.351 . . . . 0.0 111.355 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.4 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -53.88 -27.78 32.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.886 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -61.8 -55.61 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.268 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.826 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.75 55.93 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.81 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.3 mt -49.79 -29.29 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.103 0.478 . . . . 0.0 112.18 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.3 -31.75 21.43 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.842 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.826 HG21 ' O ' ' A' ' 13' ' ' LEU . 15.6 m -53.32 -33.71 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.607 ' CD1' ' HB2' ' A' ' 76' ' ' PHE . 1.1 m-85 -80.8 -56.44 4.13 Favored 'General case' 0 N--CA 1.46 0.06 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.79 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.81 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 8.6 mm-40 -48.54 -26.05 2.0 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.461 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.71 69.12 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.556 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 0.1 OUTLIER -80.37 -50.4 10.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.947 0.879 . . . . 0.0 109.805 178.533 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.584 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -61.58 -52.14 65.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.929 -1.487 . . . . 0.0 112.167 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.17 -92.96 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 68.15 -68.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.734 0.302 . . . . 0.0 111.008 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -147.09 133.14 19.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.23 -28.54 12.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.471 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.98 83.53 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.786 0.327 . . . . 0.0 110.895 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.14 167.81 9.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.6 m -98.21 26.52 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.25 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 8.5 p -149.22 -177.58 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.975 0.417 . . . . 0.0 111.15 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.584 ' HG ' ' CA ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -141.55 -124.95 0.1 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.117 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.406 ' CB ' ' HB2' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -171.44 128.48 0.68 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.428 ' HA ' HD21 ' A' ' 71' ' ' LEU . 19.6 mtmm -49.64 -41.17 41.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.858 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.631 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.65 -41.68 59.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.164 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.406 ' HB2' ' CB ' ' A' ' 31' ' ' SER . 1.6 mt-10 -55.74 -28.84 57.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -26.91 59.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.236 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -61.19 -59.15 5.77 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.488 0.661 . . . . 0.0 111.672 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.8 p -64.6 -51.16 64.15 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.611 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.556 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.7 m-85 -58.05 -50.88 71.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.979 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.3 ttm -58.62 -26.98 64.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.3 m-20 -73.25 -19.46 61.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.73 -79.96 0.59 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.511 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.66 -46.22 63.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.234 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.417 ' CD2' HG22 ' B' ' 6' ' ' THR . 6.4 mt -111.21 38.46 2.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.0 110.318 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.1 -30.32 58.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.774 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.28 -25.15 13.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.987 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.43 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.5 m-85 -109.39 23.65 14.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.011 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -179.73 39.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.87 0.367 . . . . 0.0 110.972 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.19 -35.84 3.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.07 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -163.04 30.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -71.33 158.47 36.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -28.29 65.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.999 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.79 106.39 55.37 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.42 8.16 4.56 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.523 2.149 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.01 -3.01 36.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.852 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.7 t -55.35 -53.29 37.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 120.694 0.283 . . . . 0.0 111.229 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.431 ' CD2' ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -67.37 -52.29 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.163 0.506 . . . . 0.0 110.663 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.431 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 3.8 t0 -59.07 -26.8 64.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.678 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.85 -43.26 93.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.05 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.79 ' HG2' ' N ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -60.87 -53.29 59.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.892 0.377 . . . . 0.0 111.522 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.79 ' N ' ' HG2' ' A' ' 59' ' ' MET . 0.0 OUTLIER -73.42 -31.68 63.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.031 -177.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.487 ' HG3' ' H ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -78.14 -51.57 10.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.833 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.487 ' H ' ' HG3' ' A' ' 61' ' ' LYS . 8.5 tmtm? -81.74 4.17 22.95 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.447 ' HG ' ' H ' ' A' ' 65' ' ' LEU . 1.1 pt? -44.36 -30.08 0.78 Allowed 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' C ' ' O ' ' A' ' 63' ' ' LEU . 30.9 t70 32.35 37.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.264 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -159.88 24.21 0.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.152 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 53.4 p30 -60.93 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.854 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 m -176.94 134.33 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.776 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -55.89 -23.4 31.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.935 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.65 -90.9 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.573 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.594 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.5 OUTLIER -149.39 -170.1 3.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.575 0.226 . . . . 0.0 111.021 -179.797 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HB3' ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -61.32 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 9.4 t70 166.72 159.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.941 0.791 . . . . 0.0 111.226 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.588 ' HB2' HG13 ' B' ' 85' ' ' VAL . 27.8 p90 -50.22 -58.65 5.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.519 -0.764 . . . . 0.0 113.004 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.5 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 37.0 tp60 -76.94 -29.29 55.57 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.278 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.557 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.97 -49.19 11.32 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.607 ' HB2' ' CD1' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -64.95 -54.91 23.12 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.621 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.475 ' HG ' ' CZ ' ' A' ' 17' ' ' PHE . 5.7 mt -53.88 -33.98 58.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.2 0.524 . . . . 0.0 110.019 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.15 -31.67 58.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.918 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.591 HD23 ' N ' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -70.36 -57.95 4.28 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.896 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.598 HG23 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.17 -42.8 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 CA-C-O 120.721 0.296 . . . . 0.0 110.434 178.424 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.74 -50.7 48.51 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.204 -0.998 . . . . 0.0 110.736 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -52.66 -36.7 49.28 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.768 178.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 7.1 mt -63.64 -45.79 88.59 Favored 'General case' 0 CA--C 1.518 -0.27 0 O-C-N 122.692 -0.299 . . . . 0.0 110.452 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 88' ' ' HIS . . . -54.97 -32.02 61.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.32 0.581 . . . . 0.0 110.413 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.576 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.45 -17.58 9.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.347 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.84 13.66 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.379 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.43 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 1.7 t -154.4 -42.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 -179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.43 ' HB3' ' O ' ' A' ' 84' ' ' ALA . 39.6 t60 -87.67 150.19 23.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.927 0.394 . . . . 0.0 110.712 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.69 110.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.215 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.3 m -178.94 -62.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.837 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.422 ' HB2' HG11 ' A' ' 85' ' ' VAL . 1.7 m-85 -115.11 -32.85 5.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.157 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t -44.54 139.01 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.593 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.22 39.87 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -167.76 -41.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.316 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.8 -53.14 1.21 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.486 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.528 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 75.5 Cg_exo -52.18 -47.76 25.14 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.666 2.244 . . . . 0.0 112.938 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 52.8 Cg_endo -69.5 -22.24 33.57 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.105 1.87 . . . . 0.0 112.511 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.59 117.61 16.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.15 -50.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.907 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -175.98 -51.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.928 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.854 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.824 0.345 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.418 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 0.3 OUTLIER 179.75 -51.33 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.418 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 23.9 Cg_exo -68.54 -132.6 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.041 2.494 . . . . 0.0 111.915 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.44 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER 175.24 150.73 0.11 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.436 0.636 . . . . 0.0 110.974 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.79 -49.22 10.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.395 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.477 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 4.0 m -64.14 -32.51 74.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.414 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.447 ' HA ' ' CD1' ' B' ' 10' ' ' ILE . 0.0 OUTLIER -52.13 -40.57 61.53 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' B' ' 12' ' ' SER . 0.0 OUTLIER -74.78 -26.84 60.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.44 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . . . . . . . . . 73.7 m -68.17 -53.9 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.508 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.5 HG12 ' CD1' ' A' ' 80' ' ' ILE . 1.8 mp -50.71 -56.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.889 0.376 . . . . 0.0 111.339 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.405 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.9 OUTLIER -53.91 -27.73 32.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.864 -179.338 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.439 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.9 OUTLIER -61.9 -55.59 28.12 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.823 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.77 55.86 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.814 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.2 mt -49.65 -29.4 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 CA-C-O 121.09 0.471 . . . . 0.0 112.162 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.2 -31.86 21.52 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.827 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.823 HG21 ' O ' ' B' ' 13' ' ' LEU . 15.6 m -53.23 -33.86 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 177.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.607 ' CD1' ' HB2' ' B' ' 76' ' ' PHE . 1.1 m-85 -80.74 -56.48 4.11 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.809 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.814 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 8.7 mm-40 -48.49 -26.12 2.0 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.442 -179.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -50.72 69.21 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.555 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 0.1 OUTLIER -80.35 -50.38 10.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.919 0.866 . . . . 0.0 109.859 178.481 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.581 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -61.6 -52.11 65.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.888 -1.506 . . . . 0.0 112.173 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.19 -92.95 0.14 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.44 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 68.17 -68.35 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.851 0.358 . . . . 0.0 111.059 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -147.02 133.15 19.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.786 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.09 -28.44 12.85 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.511 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.89 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.847 0.356 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.16 167.81 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.876 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 29.9 m -98.15 26.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.285 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.41 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 8.1 p -149.2 -177.59 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.958 0.409 . . . . 0.0 111.119 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.581 ' HG ' ' CA ' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -141.49 -124.96 0.1 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.129 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.412 ' CB ' ' HB2' ' B' ' 34' ' ' GLU . 0.1 OUTLIER -171.45 128.6 0.68 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.436 ' HA ' HD21 ' B' ' 71' ' ' LEU . 19.6 mtmm -49.68 -41.18 42.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.622 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.64 -41.73 59.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.153 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.412 ' HB2' ' CB ' ' B' ' 31' ' ' SER . 1.6 mt-10 -55.75 -28.8 57.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 0.0 110.376 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.36 -26.82 58.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.171 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.622 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.2 mm? -61.22 -59.16 5.75 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.568 0.699 . . . . 0.0 111.717 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 46.6 p -64.49 -51.15 64.43 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.694 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.555 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.8 m-85 -58.09 -50.87 71.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.99 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' MET . . . . . . . . . . . . . 3.3 ttm -58.64 -27.06 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 110.5 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 13.6 m-20 -73.16 -19.39 61.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.77 -79.92 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.567 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.62 -46.33 63.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.13 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.422 ' CD2' HG22 ' A' ' 6' ' ' THR . 6.4 mt -111.2 38.49 2.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.272 0.558 . . . . 0.0 110.292 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.11 -30.27 58.18 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.826 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.29 -25.19 13.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.427 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.5 m-85 -109.44 23.76 14.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.006 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.2 t -179.78 39.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.21 -35.85 3.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -163.09 30.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.883 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -71.28 158.47 36.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -28.38 65.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.962 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.71 106.45 55.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.811 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -81.42 8.06 4.62 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.536 2.157 . . . . 0.0 112.846 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -106.97 -2.97 36.47 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.896 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 94.3 t -55.36 -53.27 37.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.711 0.291 . . . . 0.0 111.286 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.429 ' CD2' ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -67.35 -52.31 41.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.126 0.489 . . . . 0.0 110.654 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.429 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 3.8 t0 -59.01 -26.95 64.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.667 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.7 -43.23 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.051 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.778 ' HG2' ' N ' ' B' ' 60' ' ' MET . 0.0 OUTLIER -60.94 -53.35 58.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 111.455 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.778 ' N ' ' HG2' ' B' ' 59' ' ' MET . 0.0 OUTLIER -73.39 -31.7 64.04 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.017 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.487 ' HG3' ' H ' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -78.12 -51.51 10.15 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.838 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.487 ' H ' ' HG3' ' B' ' 61' ' ' LYS . 8.5 tmtm? -81.78 4.12 23.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.8 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.447 ' HG ' ' H ' ' B' ' 65' ' ' LEU . 1.1 pt? -44.39 -30.07 0.78 Allowed 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . 0.409 ' C ' ' O ' ' B' ' 63' ' ' LEU . 31.0 t70 32.37 37.68 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.498 . . . . 0.0 112.289 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' B' ' 63' ' ' LEU . 0.6 OUTLIER -159.81 24.07 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.213 -179.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 53.5 p30 -60.8 -173.83 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.874 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 2.9 m -176.89 134.29 0.2 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -55.92 -23.33 30.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.947 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.73 -90.92 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.536 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.591 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.5 OUTLIER -149.33 -170.15 3.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.54 0.21 . . . . 0.0 111.039 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.548 ' HB3' ' HE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -61.28 -129.62 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 9.4 t70 166.76 159.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.576 ' HB2' HG13 ' A' ' 85' ' ' VAL . 27.5 p90 -50.2 -58.71 5.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.951 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.49 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 36.9 tp60 -76.95 -29.22 55.5 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.326 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.559 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.92 -49.2 11.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.607 ' HB2' ' CD1' ' B' ' 17' ' ' PHE . 0.1 OUTLIER -65.01 -54.85 23.86 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.616 179.281 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.48 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 5.6 mt -53.88 -34.0 58.15 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 110.031 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.423 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.06 -31.71 58.94 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 177.84 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.591 HD23 ' N ' ' B' ' 79' ' ' LEU . 0.2 OUTLIER -70.3 -57.92 4.33 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.977 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.601 HG23 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -73.18 -42.83 58.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 120.713 0.292 . . . . 0.0 110.38 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.63 49.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.167 -1.016 . . . . 0.0 110.758 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.432 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -52.73 -36.63 49.68 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.719 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 7.1 mt -63.64 -45.9 88.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 O-C-N 122.698 -0.295 . . . . 0.0 110.449 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.437 ' O ' ' HB3' ' B' ' 88' ' ' HIS . . . -54.97 -32.0 61.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.295 0.569 . . . . 0.0 110.429 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.588 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.63 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.443 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.81 13.67 17.24 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.307 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.433 ' N ' ' O ' ' B' ' 83' ' ' LEU . 1.7 t -154.4 -42.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.437 ' HB3' ' O ' ' B' ' 84' ' ' ALA . 39.5 t60 -87.67 150.08 23.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.822 0.344 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.65 110.61 0.53 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.23 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.3 m -178.94 -62.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . 0.422 ' HB2' HG11 ' B' ' 85' ' ' VAL . 1.7 m-85 -115.15 -32.8 5.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.057 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t -44.59 139.06 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.501 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.17 39.87 9.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.891 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -167.73 -41.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.399 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -78.78 -53.13 1.22 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.535 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.533 ' N ' ' HD2' ' B' ' 97' ' ' PRO . 75.1 Cg_exo -52.3 -47.65 25.81 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.626 2.218 . . . . 0.0 112.935 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 53.2 Cg_endo -69.53 -22.24 33.43 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.15 1.9 . . . . 0.0 112.512 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.64 117.7 16.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.874 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.16 -50.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.991 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -176.0 -51.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.855 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.864 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.86 0.362 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 7' ' ' GLU . 0.5 OUTLIER -179.55 -50.16 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.114 179.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 13.2 Cg_exo -77.29 19.44 0.71 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.48 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -61.59 143.56 55.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.394 0.616 . . . . 0.0 111.23 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.49 -42.0 6.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.43 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.494 ' O ' ' SG ' ' A' ' 9' ' ' CYS . 0.5 OUTLIER -72.17 -41.74 66.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 109.998 179.188 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.48 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 4.5 mm-40 -51.97 -45.85 64.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.984 0.421 . . . . 0.0 109.92 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -73.58 -26.62 60.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.584 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -64.55 -41.15 96.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.527 -179.507 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.586 ' O ' HG13 ' A' ' 14' ' ' ILE . 3.4 mp -73.8 -51.31 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.492 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -51.83 -27.29 12.03 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.641 0.238 . . . . 0.0 111.641 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.517 ' HB3' ' HB2' ' B' ' 9' ' ' CYS . 1.4 t -76.67 -55.73 5.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.653 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.816 ' O ' HG23 ' A' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.48 65.16 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.596 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 20.1 mt -69.96 -41.53 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.865 0 CA-C-O 121.766 0.793 . . . . 0.0 110.741 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.59 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -73.99 -37.82 64.31 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.512 -175.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 13' ' ' LEU . 21.1 m -52.51 -36.99 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 121.731 0.777 . . . . 0.0 109.072 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.633 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 2.9 t80 -80.52 -57.06 3.76 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 114.418 -1.265 . . . . 0.0 113.221 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.718 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -70.55 -24.48 62.8 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -52.16 64.19 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.415 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.513 ' CE1' ' CD2' ' A' ' 38' ' ' PHE . 4.6 m-85 -80.51 -38.45 29.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.763 0.792 . . . . 0.0 109.473 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.718 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.16 -26.62 64.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.746 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -101.46 -104.12 2.72 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.519 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.2 73.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 110.781 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.27 37.25 14.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.74 104.32 0.21 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.556 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -70.9 139.47 50.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 0.0 110.933 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.2 p -175.69 165.67 3.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -107.3 31.96 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -155.33 -178.34 7.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.468 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -136.82 -123.86 0.14 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.101 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.432 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 5.3 t -175.68 130.33 0.26 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.435 ' CB ' ' HE3' ' A' ' 60' ' ' MET . 0.4 OUTLIER -49.65 -41.41 42.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.011 0.434 . . . . 0.0 110.474 -179.788 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.468 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 0.9 OUTLIER -61.95 -50.35 72.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.313 179.317 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.432 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -57.8 -37.13 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -73.4 -31.03 63.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.272 178.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.76 -59.36 5.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.454 0.645 . . . . 0.0 110.217 179.112 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.18 -26.94 68.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.672 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.513 ' CD2' ' CE1' ' A' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.59 85.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.746 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.456 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 1.1 mtp -69.11 -35.23 76.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.133 0.492 . . . . 0.0 110.354 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.5 -19.24 60.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.879 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 6.3 t -110.38 -37.27 5.56 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -128.16 -27.01 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.456 ' CB ' ' HA ' ' A' ' 39' ' ' MET . 5.1 mt -112.07 44.29 1.43 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.526 0.679 . . . . 0.0 109.718 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -78.68 -25.63 44.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.906 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.38 -23.41 65.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.444 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -86.11 -32.33 21.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.542 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.9 p -86.1 -34.14 20.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.177 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -58.87 -78.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.859 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.25 55.91 3.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.583 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -59.66 -50.48 73.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.064 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 25.2 tttt 56.29 24.26 8.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.466 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -177.22 120.9 0.27 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.508 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -83.13 15.98 1.97 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.564 2.176 . . . . 0.0 112.825 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.429 ' O ' ' CB ' ' A' ' 58' ' ' ARG . . . -118.02 9.84 13.82 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.624 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.421 ' CG1' ' HB3' ' A' ' 86' ' ' ALA . 68.0 t -84.64 -64.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.027 0.442 . . . . 0.0 111.072 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.01 -51.69 10.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.099 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 29.2 t70 -59.85 -35.76 75.42 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 54' ' ' GLY . 3.2 tpm_? -58.77 -52.3 66.3 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.52 ' HE2' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -75.34 -54.17 7.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.821 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.435 ' HE3' ' CB ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -53.12 -29.81 33.07 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -78.75 -61.19 2.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 0.0 111.136 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 6.18 13.01 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.094 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' A' ' 59' ' ' MET . 1.4 pt? -47.17 -22.84 0.42 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 76.65 52.91 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.977 0.417 . . . . 0.0 110.8 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.45 ' CD2' ' HG ' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -118.3 60.67 0.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.399 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -80.95 57.0 2.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.106 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.7 m 46.35 29.67 0.9 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.333 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.53 27.42 3.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.609 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.406 ' O ' ' HG2' ' A' ' 70' ' ' GLN . . . 140.79 -101.23 0.29 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.481 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 69' ' ' GLY . 8.5 mm100 -166.47 -167.83 1.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.468 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -62.42 -133.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.45 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 4.6 t0 177.19 -178.95 0.19 Allowed 'General case' 0 N--CA 1.461 0.1 0 O-C-N 121.811 -0.556 . . . . 0.0 110.985 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.538 ' CD2' HG21 ' B' ' 85' ' ' VAL . 44.1 p90 -69.22 -55.89 9.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.328 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.566 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -80.5 -26.3 38.26 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.74 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.67 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -44.62 -35.94 2.83 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.274 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.545 ' O ' ' N ' ' A' ' 80' ' ' ILE . 2.1 t80 -77.87 -54.01 6.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.638 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.85 -33.4 68.61 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.566 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.04 -49.23 18.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.366 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 1.041 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 5.6 mp -65.62 -61.5 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.863 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.545 ' N ' ' O ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -57.86 -44.58 86.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.574 178.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.403 ' N ' ' CG2' ' A' ' 80' ' ' ILE . . . -60.77 -50.24 69.7 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 178.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.406 ' HA2' ' CG2' ' A' ' 85' ' ' VAL . . . -58.86 -39.77 94.34 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.053 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 1.041 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.8 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 88' ' ' HIS . . . -58.79 -41.45 86.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.544 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.562 ' HA ' ' HB2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -74.22 -17.29 16.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.321 -179.139 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.421 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . . . -109.34 17.59 21.33 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.329 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.44 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.586 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.497 ' N ' ' O ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.71 2.53 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.465 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.562 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 0.0 OUTLIER -178.86 -168.84 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 111.248 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.11 -27.39 57.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.661 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -53.96 52.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.757 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m -82.77 -24.75 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.248 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -13.36 55.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.417 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.15 -38.39 24.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.72 0.295 . . . . 0.0 111.193 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -133.01 52.56 8.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.284 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.492 ' HG2' ' CD ' ' A' ' 97' ' ' PRO . 1.1 Cg_endo -40.62 -58.42 0.99 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.364 2.709 . . . . 0.0 112.967 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.492 ' CD ' ' HG2' ' A' ' 96' ' ' PRO . 58.1 Cg_endo -70.39 -34.36 12.62 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.293 1.996 . . . . 0.0 112.02 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -79.15 103.56 9.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.873 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.44 -44.3 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.928 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -51.13 164.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.113 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.906 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.433 ' O ' ' CB ' ' B' ' 7' ' ' GLU . 0.5 OUTLIER -179.54 -50.05 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.118 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 13.2 Cg_exo -77.43 19.56 0.72 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.418 2.745 . . . . 0.0 113.326 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.475 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER -61.78 143.51 56.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.43 0.633 . . . . 0.0 111.223 -179.314 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.44 -42.03 6.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.339 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.493 ' O ' ' SG ' ' B' ' 9' ' ' CYS . 0.5 OUTLIER -72.1 -41.85 66.81 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.002 0.429 . . . . 0.0 109.989 179.197 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.475 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 4.5 mm-40 -51.86 -45.82 64.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.021 0.439 . . . . 0.0 109.931 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -73.59 -26.67 60.92 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.611 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -64.58 -41.03 96.54 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.597 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.6 ' O ' HG13 ' B' ' 14' ' ' ILE . 3.4 mp -73.92 -51.32 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.839 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.494 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -51.88 -27.17 11.91 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.526 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 1.4 t -76.78 -55.75 5.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.523 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.809 ' O ' HG23 ' B' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.44 65.13 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.6 HG13 ' O ' ' B' ' 10' ' ' ILE . 20.2 mt -69.94 -41.48 79.49 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.876 0 CA-C-O 121.878 0.847 . . . . 0.0 110.838 178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . 0.598 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -74.05 -37.82 64.16 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 113.513 -1.676 . . . . 0.0 112.523 -175.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.809 HG23 ' O ' ' B' ' 13' ' ' LEU . 21.0 m -52.44 -36.97 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-O 121.718 0.77 . . . . 0.0 109.092 177.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.624 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 2.9 t80 -80.44 -57.24 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.462 -1.245 . . . . 0.0 113.232 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.715 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.8 OUTLIER -70.46 -24.49 62.89 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -177.456 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.17 64.2 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.378 -179.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.503 ' CE1' ' CD2' ' B' ' 38' ' ' PHE . 4.6 m-85 -80.53 -38.44 29.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.796 0.808 . . . . 0.0 109.421 177.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.715 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.23 -26.57 65.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.746 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -101.47 -104.1 2.72 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.565 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.14 73.01 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 110.798 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.38 37.2 13.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.76 104.39 0.21 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.435 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -70.92 139.49 50.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 110.965 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -175.72 165.76 3.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 23.5 m -107.39 31.88 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.088 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.0 p -155.32 -178.37 7.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.473 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.0 OUTLIER -136.78 -123.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.151 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.434 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 5.3 t -175.66 130.28 0.26 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.675 0.274 . . . . 0.0 110.281 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.427 ' CB ' ' HE3' ' B' ' 60' ' ' MET . 0.4 OUTLIER -49.6 -41.32 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 0.0 110.503 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.469 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 0.9 OUTLIER -62.07 -50.32 72.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.293 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 0.5 OUTLIER -57.85 -37.07 73.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.279 0.561 . . . . 0.0 109.6 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -73.38 -31.07 63.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.274 178.234 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.1 OUTLIER -58.79 -59.32 5.61 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.463 0.649 . . . . 0.0 110.226 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.25 -26.9 68.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.659 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.503 ' CD2' ' CE1' ' B' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.53 85.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.748 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.447 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 1.1 mtp -69.2 -35.09 75.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.09 0.471 . . . . 0.0 110.369 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.56 -19.22 60.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.9 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.401 HG22 ' O ' ' B' ' 38' ' ' PHE . 6.3 t -110.46 -37.19 5.56 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -128.21 -27.05 2.75 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.447 ' CB ' ' HA ' ' B' ' 39' ' ' MET . 5.1 mt -111.97 44.2 1.44 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.415 0.626 . . . . 0.0 109.707 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -78.58 -25.68 45.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.948 -179.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.34 -23.43 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.401 ' O ' ' NE2' ' B' ' 50' ' ' GLN . 3.9 m-85 -86.05 -32.38 21.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.8 p -86.1 -34.18 20.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -58.94 -78.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.828 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.26 55.85 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.464 . . . . 0.0 110.579 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' B' ' 46' ' ' PHE . 1.7 mm-40 -59.56 -50.48 73.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.115 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 25.1 tttt 56.31 24.18 8.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.464 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -177.19 120.9 0.27 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.525 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -83.12 15.95 1.98 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.593 2.196 . . . . 0.0 112.759 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' B' ' 58' ' ' ARG . . . -118.09 9.94 13.66 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.56 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.422 ' CG1' ' HB3' ' B' ' 86' ' ' ALA . 67.3 t -84.71 -64.56 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.976 0.417 . . . . 0.0 111.163 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 5.5 tp -76.94 -51.84 10.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.093 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.492 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 29.2 t70 -59.74 -35.79 75.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.673 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.428 ' CB ' ' O ' ' B' ' 54' ' ' GLY . 3.2 tpm_? -58.77 -52.36 66.04 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.513 ' HE2' ' O ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -75.33 -54.12 7.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.436 ' HE1' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER -53.14 -29.78 33.24 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.585 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -78.7 -61.2 2.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 0.0 111.207 179.438 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 6.2 12.95 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.167 -179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.454 ' N ' ' O ' ' B' ' 59' ' ' MET . 1.4 pt? -47.19 -22.81 0.43 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 76.58 52.93 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.956 0.408 . . . . 0.0 110.793 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.452 ' CD2' ' HG ' ' B' ' 63' ' ' LEU . 0.6 OUTLIER -118.23 60.74 0.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.4 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.98 56.89 2.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.092 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.7 m 46.37 29.62 0.9 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.395 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.41 27.33 3.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.693 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.413 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . 140.77 -101.22 0.29 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.477 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' B' ' 69' ' ' GLY . 8.4 mm100 -166.54 -167.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.588 0.232 . . . . 0.0 110.414 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.473 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -62.55 -133.86 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.458 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 4.5 t0 177.2 -179.0 0.19 Allowed 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.473 0.579 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.531 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.8 p90 -69.07 -56.01 9.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.384 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -80.45 -26.24 38.46 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.821 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.673 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.66 -35.92 2.85 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.342 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 2.1 t80 -77.8 -54.15 6.67 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.629 178.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 6.2 mt -57.72 -33.58 68.57 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -75.84 -49.34 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 1.041 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 5.6 mp -65.63 -61.43 2.09 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.872 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.495 ' N ' ' O ' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -57.87 -44.54 86.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.585 178.746 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.405 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -60.78 -50.35 68.58 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.404 ' HA2' ' CG2' ' B' ' 85' ' ' VAL . . . -58.79 -39.68 94.07 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.189 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 1.041 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.81 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' B' ' 88' ' ' HIS . . . -58.78 -41.44 86.66 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.64 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.582 ' HA ' ' HB2' ' B' ' 89' ' ' GLU . 0.0 OUTLIER -74.16 -17.39 16.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.404 -179.259 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . 0.422 ' HB3' ' CG1' ' B' ' 55' ' ' VAL . . . -109.25 17.67 21.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.458 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.45 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.526 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.496 ' N ' ' O ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.74 2.53 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.439 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.582 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 0.0 OUTLIER -178.88 -168.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.322 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.12 -27.33 57.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.649 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -53.89 53.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m -82.78 -24.74 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.269 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.12 -13.36 55.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.481 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -82.11 -38.36 24.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.776 0.322 . . . . 0.0 111.294 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.403 ' N ' ' CD ' ' B' ' 96' ' ' PRO . . . -132.98 52.56 8.96 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.326 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.491 ' HG2' ' CD ' ' B' ' 97' ' ' PRO . 1.1 Cg_endo -40.7 -58.34 1.02 Allowed 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.408 2.739 . . . . 0.0 112.999 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.491 ' CD ' ' HG2' ' B' ' 96' ' ' PRO . 57.8 Cg_endo -70.42 -34.29 12.64 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.321 2.014 . . . . 0.0 112.091 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -79.15 103.58 9.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.85 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.47 -44.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.985 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -51.13 164.34 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.132 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.929 -179.894 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.857 0.36 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -128.22 143.19 47.12 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 2' ' ' ARG . 38.5 Cg_exo -65.16 -128.88 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.976 2.45 . . . . 0.0 111.943 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -165.85 149.81 8.03 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.397 0.618 . . . . 0.0 110.865 -179.85 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.9 -47.64 11.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.528 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.502 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 2.6 m -66.79 -34.77 78.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.628 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.59 -39.19 57.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.704 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.11 -26.67 60.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.965 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HA ' ' CB ' ' B' ' 12' ' ' SER . 76.3 m -69.8 -52.65 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.532 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -58.26 -56.65 14.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.565 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.56 -27.07 15.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.518 -179.627 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.474 ' O ' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -64.39 -55.88 18.05 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.907 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.903 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.9 mm? -74.25 -27.28 60.68 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.852 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.5 mt -66.73 -35.95 76.05 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 O-C-N 121.73 -0.606 . . . . 0.0 110.824 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.86 61.17 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.25 -176.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.903 HG21 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -53.84 -36.18 29.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.471 0.653 . . . . 0.0 109.74 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.581 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -80.17 -60.04 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.725 -178.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.852 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.2 OUTLIER -66.7 -28.64 68.6 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.11 -50.99 57.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.948 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.484 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -79.67 -31.84 41.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.583 0.706 . . . . 0.0 109.562 178.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.598 ' HB2' ' HA ' ' A' ' 18' ' ' GLN . . . -71.55 -6.99 44.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 114.737 -1.12 . . . . 0.0 112.003 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -88.11 -169.69 45.37 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.501 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 mttt 59.82 63.89 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 110.908 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.42 -72.5 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.872 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.14 -89.06 0.11 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.591 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -100.78 166.17 11.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.792 0.33 . . . . 0.0 110.853 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.6 p 58.24 167.68 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' A' ' 29' ' ' THR . 3.3 m -107.75 -115.63 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.0 p 54.09 163.22 0.01 OUTLIER 'General case' 0 C--N 1.339 0.143 0 CA-C-O 121.26 0.553 . . . . 0.0 111.637 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.552 HD22 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -114.98 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.13 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.443 ' N ' HD23 ' A' ' 30' ' ' LEU . 14.0 t 175.33 130.03 0.03 OUTLIER 'General case' 0 C--O 1.231 0.113 0 O-C-N 122.21 -0.306 . . . . 0.0 110.387 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.429 ' N ' HD21 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -51.91 -32.38 32.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.987 0.422 . . . . 0.0 110.757 -179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.545 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -68.15 -48.61 64.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.024 179.291 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -28.74 70.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -70.8 -33.36 70.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.6 178.498 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.77 -59.73 4.97 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.502 0.668 . . . . 0.0 111.137 179.881 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.0 m -59.54 -34.02 72.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.06 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CE1' ' CB ' ' A' ' 42' ' ' GLU . 72.8 t80 -60.07 -55.02 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.676 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.46 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -58.57 -28.93 66.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.81 -19.77 60.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.88 -80.95 0.63 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' CB ' ' CE1' ' A' ' 38' ' ' PHE . 2.3 mm-40 -55.59 -24.31 32.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.46 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 11.4 mt -135.04 48.76 2.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.024 0.44 . . . . 0.0 110.838 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.41 -28.15 62.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.325 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.85 -24.75 62.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.636 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -102.26 26.9 7.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.0 t 179.25 38.27 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.773 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.06 -37.1 7.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.988 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -113.12 -13.31 13.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.039 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 55.9 56.94 5.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 111.183 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -68.14 -32.92 73.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.502 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -133.17 71.08 77.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.625 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.64 118.31 4.57 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.494 2.129 . . . . 0.0 112.219 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . 134.97 -35.38 2.2 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.29 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -47.72 -53.58 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 111.032 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.448 ' CD2' ' C ' ' A' ' 56' ' ' LEU . 5.5 tt -68.46 -52.62 30.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.433 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.02 -33.4 68.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.212 -178.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.46 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -58.86 -54.18 50.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.251 . . . . 0.0 111.56 -179.134 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.651 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -76.48 -42.56 43.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.415 ' HG3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -73.19 -54.76 7.66 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.618 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.413 ' CG ' ' N ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -70.66 -51.75 25.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.783 0.325 . . . . 0.0 111.254 -179.254 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -80.6 7.36 10.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.304 179.511 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.491 ' HG ' ' HG ' ' A' ' 65' ' ' LEU . 1.0 OUTLIER -44.11 -27.85 0.43 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.18 -179.195 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 37.85 64.57 0.66 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.842 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.491 ' HG ' ' HG ' ' A' ' 63' ' ' LEU . 68.6 mt -55.94 -70.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.904 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 43.87 29.86 0.34 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.598 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.2 t -98.44 -73.69 0.61 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.008 0.432 . . . . 0.0 110.623 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 p30 -143.41 34.47 1.31 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.198 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 63.85 35.25 91.77 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.905 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.478 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.0 mm-40 -157.23 166.31 33.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.745 0.307 . . . . 0.0 111.202 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.462 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.26 -130.22 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 119.119 -0.467 . . . . 0.0 109.888 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.462 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.5 t0 175.31 -173.98 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.324 0.965 . . . . 0.0 112.375 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.574 ' CD2' HG21 ' B' ' 85' ' ' VAL . 43.5 p90 -83.2 -57.16 3.38 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.071 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.466 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.76 48.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.422 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.694 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.61 -48.27 10.41 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.521 ' CB ' ' HB2' ' A' ' 17' ' ' PHE . 1.7 t80 -65.21 -52.95 51.49 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.298 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.434 ' O ' ' N ' ' A' ' 81' ' ' GLY . 6.1 mt -53.2 -38.96 63.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.145 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.36 -36.61 58.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.849 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -61.5 -57.23 12.97 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.841 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.521 HD13 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.21 -44.8 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.802 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -50.7 48.58 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -56.56 -31.26 60.07 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.225 -0.988 . . . . 0.0 111.525 177.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 16.6 mt -66.54 -44.77 81.49 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.471 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.73 -33.86 64.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.272 0.558 . . . . 0.0 110.776 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.573 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.96 9.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.736 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -115.13 14.31 16.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.189 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.63 -40.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.399 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.7 t-160 -93.4 177.99 5.86 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.876 0.37 . . . . 0.0 111.123 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.54 93.55 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.92 111.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 1.1 t80 68.69 -67.06 0.22 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.714 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.0 p -61.56 -24.2 33.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.1 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -23.31 26.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.184 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.92 19.14 9.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.464 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -102.46 -54.62 0.12 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.677 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.486 ' N ' ' CD ' ' A' ' 97' ' ' PRO . 62.1 Cg_exo -54.1 -43.99 53.4 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.571 2.181 . . . . 0.0 112.892 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 97.6 Cg_endo -85.36 30.11 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.577 2.185 . . . . 0.0 112.904 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -158.64 31.32 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.76 35.1 3.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.76 -46.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.7 t80 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.927 179.956 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 32.3 p . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.843 0.354 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -128.25 143.17 47.06 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.862 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' B' ' 2' ' ' ARG . 38.6 Cg_exo -65.19 -128.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.933 2.422 . . . . 0.0 111.874 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.4 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -165.84 149.89 8.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.414 0.626 . . . . 0.0 110.855 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -47.6 11.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.606 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.495 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 2.6 m -66.72 -34.79 78.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.678 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.421 ' HA ' HD11 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -51.56 -39.23 57.4 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.69 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.03 -26.74 60.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.983 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.415 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 78.5 m -69.87 -52.59 23.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.175 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.524 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -58.27 -56.68 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.764 0.316 . . . . 0.0 111.414 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.555 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.55 -27.07 15.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.452 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.471 ' O ' HG12 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -64.41 -55.93 17.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.875 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.924 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.9 mm? -74.11 -27.34 60.83 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.854 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.5 mt -66.77 -35.97 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-O 121.387 0.613 . . . . 0.0 110.785 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.8 61.19 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.228 -1.351 . . . . 0.0 112.331 -176.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.924 HG21 ' O ' ' B' ' 13' ' ' LEU . 19.0 m -53.88 -36.12 29.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.467 0.651 . . . . 0.0 109.714 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.598 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 0.8 OUTLIER -80.19 -60.11 2.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.865 -1.062 . . . . 0.0 112.654 -178.668 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.854 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.2 OUTLIER -66.74 -28.58 68.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.293 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.06 -50.93 57.72 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.482 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -79.74 -31.81 41.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 109.606 177.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' B' ' 17' ' ' PHE . . . -71.52 -6.98 44.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.009 -179.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -88.27 -169.6 45.2 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.545 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 mttt 59.73 64.0 1.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.954 0.407 . . . . 0.0 110.949 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.49 -72.55 0.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.18 -89.05 0.11 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.576 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -100.83 166.24 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 12.6 p 58.16 167.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.998 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' B' ' 29' ' ' THR . 3.4 m -107.75 -115.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.766 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.472 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.0 p 53.93 163.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.126 0 CA-C-O 121.228 0.537 . . . . 0.0 111.676 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -115.04 0.31 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.108 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.449 ' N ' HD23 ' B' ' 30' ' ' LEU . 13.8 t 175.43 130.17 0.04 OUTLIER 'General case' 0 C--O 1.231 0.126 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.43 ' N ' HD21 ' B' ' 71' ' ' LEU . 0.0 OUTLIER -51.98 -32.33 33.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.762 -179.705 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.554 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -68.22 -48.58 64.76 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.952 179.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -28.65 70.02 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.522 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -70.84 -33.41 70.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.512 178.504 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.2 OUTLIER -58.74 -59.72 4.96 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.431 0.634 . . . . 0.0 111.109 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -59.52 -34.03 72.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.086 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.448 ' HB2' ' CD2' ' B' ' 20' ' ' TYR . 73.1 t80 -60.09 -55.06 38.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.609 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.448 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.3 OUTLIER -58.61 -28.85 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.86 -19.72 60.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.821 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.95 -81.02 0.63 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.446 ' CB ' ' CE1' ' B' ' 38' ' ' PHE . 2.3 mm-40 -55.56 -24.24 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.496 -178.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.448 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 11.3 mt -135.11 48.79 2.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.794 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -27.99 62.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.367 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.7 62.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.722 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -102.24 26.72 7.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 5.0 t 179.38 38.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.768 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -37.05 7.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.967 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -113.09 -13.33 13.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.093 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 55.87 57.05 5.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.104 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -68.24 -32.81 73.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.53 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -133.21 71.05 77.44 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.599 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.59 118.33 4.58 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.619 2.212 . . . . 0.0 112.16 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.474 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . 134.81 -35.25 2.23 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.279 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 94.6 t -47.78 -53.51 4.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.94 0.4 . . . . 0.0 111.09 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.449 ' C ' ' CD2' ' B' ' 56' ' ' LEU . 5.5 tt -68.59 -52.5 31.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.455 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -33.35 68.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.147 -178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -58.82 -54.22 49.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.644 0.259 . . . . 0.0 111.502 -179.092 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.667 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -76.44 -42.63 43.35 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.402 ' HG3' HD12 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -73.21 -54.72 7.72 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.408 ' HG2' ' N ' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -70.64 -51.76 25.8 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.677 0.275 . . . . 0.0 111.279 -179.314 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' B' ' 58' ' ' ARG . 0.0 OUTLIER -80.61 7.36 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.301 179.487 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.488 ' CD1' HD21 ' B' ' 65' ' ' LEU . 1.0 OUTLIER -44.05 -27.92 0.43 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.166 -179.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 37.88 64.49 0.67 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.848 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.488 HD21 ' CD1' ' B' ' 63' ' ' LEU . 69.0 mt -55.9 -70.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.967 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 43.91 29.82 0.35 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.565 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.2 t -98.45 -73.66 0.61 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.647 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -143.49 34.64 1.3 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 63.72 35.3 91.84 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.01 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.472 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.0 mm-40 -157.29 166.28 33.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.715 0.293 . . . . 0.0 111.227 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.435 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -65.2 -130.26 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.45 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 1.5 t0 175.28 -174.06 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.232 0.924 . . . . 0.0 112.256 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.573 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.3 p90 -83.19 -57.07 3.43 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.095 -179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.456 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.8 48.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.444 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.688 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.63 -48.14 10.46 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.522 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 1.7 t80 -65.32 -52.86 51.21 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.32 178.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 81' ' ' GLY . 6.1 mt -53.3 -38.93 63.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.964 0.411 . . . . 0.0 110.147 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -36.81 58.27 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.849 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -61.27 -57.35 12.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.891 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.505 HD13 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.1 -44.92 30.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 123.639 0.587 . . . . 0.0 110.76 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' HG21 ' B' ' 80' ' ' ILE . . . -52.66 -50.77 47.7 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -56.66 -31.17 60.26 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 120.197 -1.002 . . . . 0.0 111.505 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.849 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 16.8 mt -66.63 -44.73 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.466 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.65 -33.94 64.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.237 0.541 . . . . 0.0 110.787 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.574 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.95 9.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.793 -179.442 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -115.14 14.47 17.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.226 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.64 -40.5 0.05 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.443 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.466 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.8 t-160 -93.44 178.0 5.85 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 120.94 0.4 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.71 93.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.273 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.93 111.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.606 179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 1.1 t80 68.67 -67.02 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.823 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.67 -24.1 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.131 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.53 -23.35 25.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.91 19.09 9.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.407 ' CB ' ' HD3' ' B' ' 96' ' ' PRO . . . -102.44 -54.7 0.12 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.595 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.482 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 59.9 Cg_exo -53.94 -44.06 52.61 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.694 2.263 . . . . 0.0 112.874 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 97.3 Cg_endo -85.43 30.15 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.554 2.169 . . . . 0.0 112.936 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -158.59 31.25 0.23 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.797 0.332 . . . . 0.0 110.81 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.8 35.15 3.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.85 -46.33 0.08 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 62.6 t80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.89 179.95 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.699 0.285 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.42 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 5.2 mtm105 -88.16 -51.24 0.4 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.976 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 29.9 Cg_exo -66.28 -129.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.089 2.526 . . . . 0.0 111.799 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.433 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -132.21 145.18 51.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.338 0.589 . . . . 0.0 111.207 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.03 10.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.101 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.499 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.52 -41.59 92.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.07 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.433 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.13 -35.72 36.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.498 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.67 -27.13 40.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.75 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.48 ' SG ' ' O ' ' A' ' 6' ' ' THR . 2.5 p -70.45 -41.37 72.93 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.296 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.628 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.9 mp -69.3 -54.95 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.731 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.534 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -51.84 -27.22 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.491 ' O ' HG12 ' A' ' 16' ' ' VAL . 6.1 m -75.25 -55.83 5.32 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.84 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.815 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.9 mm? -61.13 -27.34 68.32 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.857 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 9.3 mt -71.8 -37.4 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 CA-C-O 121.505 0.669 . . . . 0.0 110.332 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.54 64.03 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.875 -177.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.815 HG23 ' O ' ' A' ' 13' ' ' LEU . 19.4 m -53.8 -35.7 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.48 0.657 . . . . 0.0 109.479 178.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.583 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -80.33 -59.74 2.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.582 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.857 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.6 OUTLIER -69.91 -24.97 63.47 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -51.71 57.92 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.244 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.473 ' HB3' HD23 ' A' ' 30' ' ' LEU . 1.9 m-85 -80.19 -40.22 27.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.712 0.768 . . . . 0.0 109.41 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.696 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.85 -26.16 57.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.707 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -108.33 174.75 19.18 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.712 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.9 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.763 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -106.28 -32.16 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.935 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -166.25 -127.34 0.89 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -101.33 124.32 46.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.804 0.335 . . . . 0.0 110.887 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 t -114.77 160.89 18.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 p -108.98 -19.28 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.356 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.506 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 1.1 p -129.98 -176.87 4.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.753 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.477 HD22 ' N ' ' A' ' 31' ' ' SER . 0.0 OUTLIER -137.81 -122.96 0.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.524 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.477 ' N ' HD22 ' A' ' 30' ' ' LEU . 18.5 t -179.82 127.9 0.09 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.409 ' N ' HD23 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -49.77 -40.69 42.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.18 -179.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 5.0 t -61.86 -43.51 98.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.45 ' HB2' HD22 ' A' ' 30' ' ' LEU . 15.7 mt-10 -61.52 -35.75 78.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -74.2 -29.9 61.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 176.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.574 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.84 -59.36 5.35 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.873 178.914 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -63.55 -41.19 98.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.489 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.435 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 t80 -60.02 -45.22 93.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.406 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.416 ' CE ' ' CD1' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -62.46 -31.28 71.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.788 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -73.52 -19.74 60.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.39 -79.34 0.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.091 0.472 . . . . 0.0 111.862 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.435 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 2.7 mt-10 -52.07 -29.04 19.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.224 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 52.6 mt -130.41 50.14 2.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.099 0.476 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.2 -28.45 42.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.779 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.63 67.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.137 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -102.06 27.2 6.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.962 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 65.0 p -150.35 -43.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.202 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -48.62 -79.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.377 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -106.63 78.46 1.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.004 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -116.88 139.69 50.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.949 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.3 -31.37 16.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.907 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.425 ' HB3' HG21 ' A' ' 55' ' ' VAL . 1.2 t0 -83.54 110.62 25.81 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo -85.24 19.85 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.858 2.372 . . . . 0.0 112.738 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -122.68 14.79 8.56 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.625 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.425 HG21 ' HB3' ' A' ' 52' ' ' ASP . 39.0 t -84.24 -61.22 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' A' ' 59' ' ' MET . 7.7 tp -67.67 -51.16 53.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.96 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.84 -27.0 49.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -50.52 71.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.053 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.685 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 2.4 ptp -57.07 -53.52 57.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.277 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.503 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -58.73 -22.91 58.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.364 -179.534 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -78.56 -60.37 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.951 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.19 6.32 12.08 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.516 ' HB3' ' O ' ' A' ' 59' ' ' MET . 0.4 OUTLIER -73.58 -5.77 42.42 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.62 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' A' ' 66' ' ' ASN . 0.7 OUTLIER 64.31 -82.23 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.688 0.28 . . . . 0.0 110.593 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' CD2' ' HG ' ' A' ' 63' ' ' LEU . 0.3 OUTLIER 62.69 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.311 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 64' ' ' ASP . 14.4 m-20 64.39 19.71 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.072 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m 50.53 -175.29 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.126 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.91 24.64 6.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.847 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' A' ' 70' ' ' GLN . . . -156.87 -142.27 3.37 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.321 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.578 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.1 OUTLIER -152.81 -174.98 5.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.779 0.323 . . . . 0.0 110.985 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.474 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -65.29 -131.38 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.932 179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.45 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 0.3 OUTLIER 172.69 -168.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.879 0.763 . . . . 0.0 111.364 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.649 ' HB2' HG13 ' B' ' 85' ' ' VAL . 39.8 p90 -80.84 -60.51 2.28 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.894 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.464 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -80.1 -22.19 42.46 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.225 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.404 ' OE2' ' CD2' ' A' ' 65' ' ' LEU . 2.1 tt0 -47.17 -32.66 4.55 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.521 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 2.3 t80 -80.51 -54.31 5.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.722 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.415 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 5.8 mt -53.75 -33.97 57.48 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.427 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.43 -40.71 49.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 177.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.685 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.7 mp -62.39 -57.64 10.55 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.03 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.518 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -75.21 -45.27 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.121 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.44 -48.87 53.87 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.441 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.47 -41.44 48.84 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.255 -0.974 . . . . 0.0 111.318 178.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.61 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 9.1 mt -56.72 -47.65 79.49 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 110.661 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.62 -32.61 63.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.184 0.516 . . . . 0.0 111.27 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.652 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.27 -17.57 9.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.607 -179.411 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.5 2.21 16.22 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.368 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.492 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -137.6 -41.48 0.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 -179.934 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.5 ' CG ' HD11 ' B' ' 14' ' ' ILE . 0.7 OUTLIER -82.09 -166.64 1.29 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.887 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.87 36.4 1.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.312 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.53 7.56 45.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.461 ' HB2' HG11 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 177.92 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.386 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.1 t -60.33 158.31 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.857 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.57 17.42 8.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.989 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -117.36 -26.72 6.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.133 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.552 ' N ' ' HD3' ' A' ' 96' ' ' PRO . . . -140.06 53.95 4.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.479 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.552 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 34.7 Cg_exo -59.34 -47.47 16.94 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.418 2.079 . . . . 0.0 112.713 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 97.7 Cg_endo -84.35 -23.49 2.85 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.633 2.222 . . . . 0.0 112.682 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.1 tm0? -50.05 149.8 2.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.301 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -121.84 102.37 8.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.879 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 -96.2 -34.85 11.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.927 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.745 0.307 . . . . 0.0 111.253 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.416 ' N ' ' CD ' ' B' ' 3' ' ' PRO . 5.2 mtm105 -88.16 -51.18 0.4 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.0 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.416 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 30.2 Cg_exo -66.38 -129.85 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.994 2.463 . . . . 0.0 111.813 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.443 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -132.2 145.13 51.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.246 0.546 . . . . 0.0 111.242 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.06 10.61 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.074 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.496 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.44 -41.62 93.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.192 0.52 . . . . 0.0 110.108 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.443 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.14 -35.71 37.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.539 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -27.25 41.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.803 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' B' ' 6' ' ' THR . 2.5 p -70.33 -41.42 73.24 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.322 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.628 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.9 mp -69.32 -54.99 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.707 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.548 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -51.75 -27.29 11.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.336 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.488 ' O ' HG12 ' B' ' 16' ' ' VAL . 6.2 m -75.25 -55.92 5.23 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.764 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.807 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.9 mm? -61.03 -27.29 68.22 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.85 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 9.3 mt -71.86 -37.42 61.63 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 121.478 0.656 . . . . 0.0 110.336 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 -39.57 64.12 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.917 -177.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.807 HG23 ' O ' ' B' ' 13' ' ' LEU . 19.4 m -53.76 -35.7 27.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.487 0.661 . . . . 0.0 109.479 178.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.576 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 0.6 OUTLIER -80.28 -59.78 2.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.617 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.85 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.6 OUTLIER -69.92 -24.92 63.45 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -178.179 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -51.79 57.14 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.258 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.486 ' HB3' HD23 ' B' ' 30' ' ' LEU . 1.9 m-85 -80.2 -40.1 27.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.68 0.752 . . . . 0.0 109.413 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.692 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -57.01 -26.09 59.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.675 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -108.26 174.83 19.31 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.718 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.99 -40.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.782 0.325 . . . . 0.0 110.766 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -106.29 -32.22 8.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -166.16 -127.35 0.89 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.501 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -101.34 124.26 46.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.776 0.322 . . . . 0.0 110.946 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.8 t -114.74 160.86 18.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.8 p -108.96 -19.2 6.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 1.1 p -130.05 -176.86 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.486 HD23 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -137.8 -122.92 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.539 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.472 ' N ' HD22 ' B' ' 30' ' ' LEU . 18.8 t -179.88 127.84 0.08 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.418 ' N ' HD23 ' B' ' 71' ' ' LEU . 0.0 OUTLIER -49.58 -40.68 39.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.239 -179.149 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.569 ' HA ' ' CD1' ' B' ' 36' ' ' LEU . 5.0 t -61.99 -43.44 98.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.455 ' HB2' HD22 ' B' ' 30' ' ' LEU . 15.7 mt-10 -61.5 -35.65 78.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.515 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -74.32 -29.85 61.79 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 176.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.569 ' CD1' ' HA ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -57.81 -59.39 5.3 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.874 178.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.9 p -63.6 -41.16 98.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.411 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.435 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 9.0 t80 -60.08 -45.19 93.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.429 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.415 ' CE ' ' CD1' ' B' ' 83' ' ' LEU . 0.0 OUTLIER -62.39 -31.39 72.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.824 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -73.4 -19.72 60.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.242 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.45 -79.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.102 0.477 . . . . 0.0 111.777 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.435 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.7 mt-10 -52.02 -29.04 19.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.224 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 53.6 mt -130.33 50.09 2.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.039 0.447 . . . . 0.0 110.811 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.22 -28.41 42.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.856 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.01 -24.71 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.072 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -102.08 27.26 6.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.96 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 65.4 p -150.36 -43.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.177 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -48.67 -79.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.38 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -106.67 78.42 1.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.004 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -116.86 139.7 50.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.962 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.34 -31.35 16.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.821 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.412 ' HB3' HG21 ' B' ' 55' ' ' VAL . 1.2 t0 -83.55 110.67 26.18 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.94 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' B' ' 52' ' ' ASP . 3.9 Cg_endo -85.31 19.88 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.866 2.377 . . . . 0.0 112.611 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -122.67 14.74 8.57 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.653 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.412 HG21 ' HB3' ' B' ' 52' ' ' ASP . 39.0 t -84.17 -61.22 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.019 0.438 . . . . 0.0 111.094 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -67.74 -51.09 53.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.997 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -55.83 -26.96 49.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.32 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -50.42 72.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.008 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.678 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 2.4 ptp -57.13 -53.48 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.293 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.506 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -58.76 -22.91 59.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.399 -179.566 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -78.59 -60.39 2.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.931 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.16 6.35 11.96 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.528 ' HB3' ' O ' ' B' ' 59' ' ' MET . 0.4 OUTLIER -73.63 -5.73 42.24 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.603 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . 0.418 ' O ' ' N ' ' B' ' 66' ' ' ASN . 0.7 OUTLIER 64.21 -82.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.654 0.264 . . . . 0.0 110.535 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.405 ' CD2' ' OE2' ' B' ' 75' ' ' GLU . 0.3 OUTLIER 62.78 -76.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.216 179.562 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' B' ' 64' ' ' ASP . 14.3 m-20 64.42 19.68 11.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.024 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m 50.58 -175.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.81 0.338 . . . . 0.0 111.107 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 54.93 24.61 6.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.768 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.427 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . -156.83 -142.31 3.38 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.313 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.572 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.1 OUTLIER -152.69 -174.9 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 110.913 -179.951 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.479 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.3 OUTLIER -65.35 -131.4 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.931 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.446 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.2 OUTLIER 172.68 -168.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.939 0.791 . . . . 0.0 111.392 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.652 ' HB2' HG13 ' A' ' 85' ' ' VAL . 39.9 p90 -80.92 -60.6 2.24 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.761 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -80.03 -22.25 42.6 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.21 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.405 ' OE2' ' CD2' ' B' ' 65' ' ' LEU . 2.1 tt0 -47.19 -32.66 4.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 178.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.515 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 2.2 t80 -80.48 -54.28 5.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.765 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' B' ' 81' ' ' GLY . 5.8 mt -53.79 -33.88 57.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.417 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -40.73 49.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.678 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.7 mp -62.24 -57.67 10.59 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.07 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.517 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -75.24 -45.32 41.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.073 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.416 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -52.5 -48.86 54.28 Favored Glycine 0 C--N 1.333 0.4 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.441 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.43 -41.36 48.38 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.359 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.617 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 9.2 mt -56.93 -47.55 80.37 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 120.676 0.274 . . . . 0.0 110.623 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.47 -32.81 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.199 0.523 . . . . 0.0 111.254 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.649 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.51 9.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.592 -179.332 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.48 2.17 16.22 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.418 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -137.59 -41.49 0.55 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.497 ' CG ' HD11 ' A' ' 14' ' ' ILE . 0.7 OUTLIER -82.06 -166.65 1.29 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.815 0.34 . . . . 0.0 110.919 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.76 36.35 1.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.346 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.56 7.53 45.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.051 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . 0.46 ' HB2' HG11 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 177.88 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 t -60.38 158.35 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.799 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.55 17.41 8.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.002 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -117.39 -26.68 6.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.128 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.556 ' N ' ' HD3' ' B' ' 96' ' ' PRO . . . -140.13 53.96 4.84 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.497 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.556 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 34.9 Cg_exo -59.27 -47.51 16.97 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.418 2.079 . . . . 0.0 112.701 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.479 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 96.6 Cg_endo -84.43 -23.32 2.87 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.517 2.145 . . . . 0.0 112.733 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 7.1 tm0? -50.06 149.72 2.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.318 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -121.71 102.32 8.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.889 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 -96.17 -34.91 11.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.9 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.827 0.346 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -99.68 167.82 10.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.45 -126.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.926 2.418 . . . . 0.0 111.835 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.434 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -177.44 149.11 0.62 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.544 0.688 . . . . 0.0 111.152 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.36 -48.98 13.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.417 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.504 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 2.3 m -64.34 -37.1 86.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.53 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.434 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.75 -38.25 54.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.727 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.87 -26.77 43.99 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.092 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.426 ' HA ' ' CB ' ' B' ' 12' ' ' SER . 63.9 m -69.23 -52.99 22.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.553 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -53.25 -56.15 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.541 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.495 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.44 -27.31 15.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.536 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -68.52 -55.9 10.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.932 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -68.68 -27.69 66.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -178.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.746 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.5 mt -68.1 -36.34 75.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 O-C-N 121.666 -0.646 . . . . 0.0 110.508 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -32.65 41.89 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.482 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.932 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.2 m -51.73 -37.14 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.559 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 4.9 t80 -78.37 -58.54 3.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.319 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.746 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.5 mm-40 -49.13 -32.92 10.85 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.23 -51.96 67.59 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.876 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.491 ' CD1' ' CD2' ' A' ' 38' ' ' PHE . 2.1 m-85 -81.2 -47.69 13.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.778 0.799 . . . . 0.0 109.963 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 17' ' ' PHE . . . -61.31 -17.03 51.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.887 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -75.32 143.15 30.22 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.491 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -165.54 -43.91 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.0 169.33 25.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.74 65.97 3.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.478 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -176.57 -39.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.773 0.32 . . . . 0.0 110.941 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -56.41 143.0 36.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.929 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.3 p -145.99 24.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.38 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.519 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -143.38 150.84 39.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.144 0.497 . . . . 0.0 111.455 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.532 HD21 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -107.69 -152.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.961 179.264 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.414 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -148.52 147.62 29.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.207 0.527 . . . . 0.0 111.089 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.425 ' HG2' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.4 -44.76 68.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.755 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.849 ' HA ' ' CD2' ' A' ' 36' ' ' LEU . 1.9 m -74.62 -36.4 62.93 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.33 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -55.06 -30.63 60.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.496 ' CE2' ' HB3' ' A' ' 79' ' ' LEU . 2.3 t80 -81.21 -47.55 13.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.272 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.849 ' CD2' ' HA ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -63.46 -28.08 69.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.783 0.325 . . . . 0.0 110.39 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.57 -28.38 33.86 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 20' ' ' TYR . 3.4 t80 -59.06 -54.79 43.09 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.983 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.556 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 2.8 mtp -48.8 -30.11 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.521 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -73.59 -19.47 60.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.186 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -105.11 -50.8 3.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.309 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -128.31 -12.55 5.07 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -177.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.556 ' CB ' ' HA ' ' A' ' 39' ' ' MET . 6.4 mt -117.48 46.71 1.66 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.353 0.597 . . . . 0.0 110.296 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.11 -30.54 27.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.993 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.43 -26.02 28.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.823 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -97.23 22.72 8.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.407 ' CG2' ' HB3' ' A' ' 39' ' ' MET . 26.2 p -147.4 -40.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.208 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -44.0 150.43 0.27 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.085 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.68 -54.69 0.67 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.95 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.28 64.57 0.1 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 111.085 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.35 10.34 31.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.941 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.406 ' O ' HG13 ' A' ' 55' ' ' VAL . 1.3 m-20 -138.57 68.26 45.06 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-O 120.93 0.395 . . . . 0.0 110.84 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -60.88 91.13 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.53 2.154 . . . . 0.0 112.023 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.58 -11.7 0.63 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.403 -0.903 . . . . 0.0 113.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.448 ' CG2' ' N ' ' A' ' 56' ' ' LEU . 2.0 m -77.44 -50.38 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 117.263 0.531 . . . . 0.0 110.53 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.448 ' N ' ' CG2' ' A' ' 55' ' ' VAL . 8.7 tp -68.99 -51.48 38.96 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.002 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.16 -28.72 69.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.212 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.61 73.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.821 0.344 . . . . 0.0 110.849 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.613 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 1.8 ptp -67.27 -53.44 29.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.138 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.507 ' N ' ' CG ' ' A' ' 59' ' ' MET . 10.0 mmt -63.66 -22.83 67.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.31 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -55.57 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.43 -3.62 50.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.235 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.51 HD23 ' N ' ' A' ' 65' ' ' LEU . 3.2 tt -68.01 -26.86 66.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.945 0.402 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 64.08 49.91 2.59 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.053 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.51 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.84 -79.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.037 -179.767 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 61.13 32.06 19.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.866 0.365 . . . . 0.0 110.588 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.6 m 67.36 141.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 63.58 167.13 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.7 -40.62 2.6 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.436 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.537 ' O ' ' O ' ' A' ' 71' ' ' LEU . 2.2 mm-40 62.96 156.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.389 0.138 . . . . 0.0 111.092 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.6 ' HG ' ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -54.2 -130.62 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.571 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.596 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 3.8 p30 162.4 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.619 ' HB2' HG11 ' B' ' 85' ' ' VAL . 41.6 p90 -83.39 -58.62 2.75 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.54 ' O ' ' N ' ' A' ' 78' ' ' ASN . 42.0 tp60 -80.33 -34.54 36.56 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.6 ' HB3' ' HG ' ' A' ' 71' ' ' LEU . 2.2 tt0 -44.49 -39.54 4.9 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.285 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 16' ' ' VAL . 3.2 t80 -71.74 -52.86 15.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.469 ' O ' ' N ' ' A' ' 81' ' ' GLY . 5.4 mt -55.62 -33.45 64.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -73.03 -40.3 65.25 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.613 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.8 mp -62.51 -57.13 12.26 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.543 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.559 HG22 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -70.45 -42.74 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 CA-C-O 120.828 0.347 . . . . 0.0 110.507 178.567 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.67 -50.58 48.57 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.413 -0.899 . . . . 0.0 110.895 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.499 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.74 -41.0 49.89 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.352 -0.927 . . . . 0.0 111.721 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.554 ' CD2' ' HE2' ' A' ' 59' ' ' MET . 4.0 mt -60.17 -46.79 88.51 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 122.634 -0.333 . . . . 0.0 110.787 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.13 58.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.093 0.473 . . . . 0.0 111.296 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.62 HG11 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.61 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.114 -178.8 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.406 ' CB ' ' HB ' ' A' ' 55' ' ' VAL . . . -117.66 8.46 12.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.963 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.82 -37.78 0.4 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.663 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.416 ' CG ' HD12 ' B' ' 14' ' ' ILE . 1.6 t60 -103.49 166.68 10.28 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.883 0.373 . . . . 0.0 111.06 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -59.75 115.7 3.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.64 -68.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.681 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -114.67 -32.56 5.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.749 179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.37 -26.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.472 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.9 ttpp -92.44 16.57 11.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.5 22.35 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.157 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -124.82 72.73 62.87 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.446 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 39.2 Cg_exo -58.92 -47.35 18.43 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.824 2.349 . . . . 0.0 112.819 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 84.3 Cg_endo -81.85 -28.51 2.08 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.412 2.075 . . . . 0.0 112.374 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.4 90.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.93 -175.19 3.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.91 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.52 -64.41 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.983 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 7.8 t80 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.89 -179.986 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.839 0.352 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -99.64 167.87 10.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.9 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.53 -126.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.986 2.457 . . . . 0.0 111.825 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.428 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -177.43 149.0 0.62 Allowed 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.51 0.671 . . . . 0.0 111.229 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.3 -49.08 12.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.323 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.495 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 2.4 m -64.32 -37.04 86.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.51 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.428 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -38.19 54.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.768 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.91 -26.82 43.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.061 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.42 ' HA ' ' CB ' ' A' ' 12' ' ' SER . 63.9 m -69.21 -52.93 22.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.244 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.547 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -53.19 -56.18 9.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.639 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.481 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.28 -27.52 15.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.757 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.54 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -68.5 -55.86 10.32 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.944 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -68.67 -27.76 66.27 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.758 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.6 mt -68.08 -36.4 75.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 O-C-N 121.724 -0.61 . . . . 0.0 110.446 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.58 -32.56 42.0 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.545 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.944 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.9 m -51.77 -37.12 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 4.8 t80 -78.39 -58.62 3.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.3 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.758 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.5 mm-40 -49.06 -32.94 10.48 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.16 -51.93 67.66 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.959 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.498 ' CD1' ' CD2' ' B' ' 38' ' ' PHE . 2.1 m-85 -81.17 -47.74 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.782 0.801 . . . . 0.0 109.952 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' B' ' 17' ' ' PHE . . . -61.43 -16.92 51.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.926 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -75.27 143.1 30.21 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.603 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -165.51 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.835 0.35 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -156.99 169.36 25.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.874 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.72 65.93 3.11 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.57 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -176.55 -39.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.341 . . . . 0.0 110.956 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -56.33 142.91 36.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.989 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p -145.9 24.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.396 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.533 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -143.39 150.83 39.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.211 0.529 . . . . 0.0 111.508 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -107.71 -152.33 0.48 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.91 179.361 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.413 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -148.49 147.51 29.19 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.128 0.489 . . . . 0.0 111.115 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.411 ' HG2' HD21 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -53.26 -44.81 68.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.751 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.865 ' HA ' ' CD2' ' B' ' 36' ' ' LEU . 1.9 m -74.61 -36.41 62.95 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.295 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.426 ' HB3' HD23 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.16 -30.59 60.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.5 ' CE2' ' HB3' ' B' ' 79' ' ' LEU . 2.3 t80 -81.28 -47.52 13.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.246 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.865 ' CD2' ' HA ' ' B' ' 33' ' ' THR . 0.6 OUTLIER -63.42 -28.03 69.7 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 120.872 0.367 . . . . 0.0 110.509 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.55 -28.42 33.91 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.222 0.534 . . . . 0.0 109.641 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.498 ' CD2' ' CD1' ' B' ' 20' ' ' TYR . 3.4 t80 -58.95 -54.79 43.17 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.01 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.56 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 2.7 mtp -48.89 -30.17 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -73.55 -19.51 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' B' ' 38' ' ' PHE . 0.7 OUTLIER -105.08 -50.74 3.17 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -178.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -128.42 -12.5 5.01 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.56 ' CB ' ' HA ' ' B' ' 39' ' ' MET . 6.4 mt -117.63 46.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.294 0.568 . . . . 0.0 110.218 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.19 -30.53 27.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.989 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.39 -26.03 27.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -97.28 22.87 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.852 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.407 ' CG2' ' HB3' ' B' ' 39' ' ' MET . 26.6 p -147.55 -40.02 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.178 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -44.05 150.41 0.28 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.002 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.79 -54.8 0.67 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.902 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.33 64.67 0.1 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.102 0.477 . . . . 0.0 111.03 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.37 10.22 31.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.962 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.41 ' O ' HG13 ' B' ' 55' ' ' VAL . 1.3 m-20 -138.52 68.22 45.39 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-O 120.942 0.401 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -60.94 91.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.536 2.157 . . . . 0.0 111.976 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.49 -11.59 0.64 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.527 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.455 ' CG2' ' N ' ' B' ' 56' ' ' LEU . 2.0 m -77.5 -50.4 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 117.281 0.541 . . . . 0.0 110.489 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.455 ' N ' ' CG2' ' B' ' 55' ' ' VAL . 8.7 tp -69.05 -51.47 38.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.96 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.14 -28.69 69.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -35.57 73.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.63 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 1.8 ptp -67.23 -53.41 30.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.507 ' N ' ' CG ' ' B' ' 59' ' ' MET . 10.0 mmt -63.7 -22.92 67.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.247 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -55.7 5.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.39 -3.58 50.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.237 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.521 HD23 ' N ' ' B' ' 65' ' ' LEU . 3.2 tt -67.97 -26.87 66.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.028 0.442 . . . . 0.0 111.026 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 64.03 50.01 2.6 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.006 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.521 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -74.83 -79.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.99 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 61.13 32.01 19.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.912 0.387 . . . . 0.0 110.677 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.6 m 67.35 141.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 63.56 167.1 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.73 -40.6 2.6 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.485 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.533 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 63.07 156.01 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.391 0.139 . . . . 0.0 111.043 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.6 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.1 OUTLIER -54.3 -130.64 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.593 -179.685 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.6 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 3.7 p30 162.53 -148.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.62 ' HB2' HG11 ' A' ' 85' ' ' VAL . 41.7 p90 -83.38 -58.57 2.77 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.586 ' O ' ' N ' ' B' ' 78' ' ' ASN . 42.1 tp60 -80.31 -34.59 36.65 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.585 ' HB3' ' HG ' ' B' ' 71' ' ' LEU . 2.2 tt0 -44.63 -39.39 4.99 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.296 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.574 ' CE1' HG21 ' B' ' 16' ' ' VAL . 3.2 t80 -71.72 -52.9 15.4 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' B' ' 81' ' ' GLY . 5.4 mt -55.56 -33.51 63.93 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -72.96 -40.35 65.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.63 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.8 mp -62.47 -57.22 12.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.472 179.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.56 HG22 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -70.43 -42.75 78.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.769 0.319 . . . . 0.0 110.497 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.476 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.67 -50.64 48.3 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.498 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.79 -40.95 50.17 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.37 -0.919 . . . . 0.0 111.725 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.555 ' CD2' ' HE2' ' B' ' 59' ' ' MET . 4.0 mt -60.09 -46.87 88.14 Favored 'General case' 0 C--N 1.332 -0.171 0 O-C-N 122.624 -0.339 . . . . 0.0 110.813 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.51 -29.1 58.25 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.089 0.471 . . . . 0.0 111.348 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.619 HG11 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.62 9.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.04 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -117.66 8.45 12.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.978 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.81 -37.81 0.4 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.655 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.415 ' CG ' HD12 ' A' ' 14' ' ' ILE . 1.6 t60 -103.5 166.61 10.32 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.922 0.391 . . . . 0.0 111.052 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.64 115.71 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.69 -68.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.703 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . 0.407 ' HB2' HG12 ' B' ' 85' ' ' VAL . 4.5 t80 -114.58 -32.49 5.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.77 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.45 -26.15 5.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.505 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -92.34 16.5 11.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.143 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.48 22.32 3.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.157 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -124.81 72.69 62.66 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.148 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.448 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 40.2 Cg_exo -58.99 -47.28 18.52 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.695 2.263 . . . . 0.0 112.864 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.448 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 84.7 Cg_endo -81.79 -28.5 2.11 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 0.0 112.387 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -57.42 90.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.02 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.84 -175.07 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.865 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -64.49 1.04 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 7.9 t80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.897 -179.993 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.772 0.32 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.13 76.23 73.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.826 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -63.7 -127.11 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.163 2.575 . . . . 0.0 112.167 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -145.69 152.09 39.07 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.359 0.6 . . . . 0.0 111.106 -179.783 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -44.84 -49.31 10.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.621 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.477 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.3 OUTLIER -62.53 -39.11 92.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.122 0.487 . . . . 0.0 109.894 178.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.522 ' HA ' HD11 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -51.63 -30.25 20.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.293 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -27.91 41.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.777 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.443 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 5.5 p -75.3 -41.79 56.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.261 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.582 ' O ' HG13 ' A' ' 14' ' ' ILE . 1.9 mp -68.26 -53.81 26.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.869 0.366 . . . . 0.0 111.301 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.469 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -51.88 -27.29 12.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.101 -178.651 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.517 ' O ' HG13 ' A' ' 16' ' ' VAL . 9.1 m -73.65 -56.05 5.5 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.873 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.6 mm? -63.43 -28.76 70.19 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.688 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 14.4 mt -68.97 -38.53 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.881 0 CA-C-O 121.593 0.711 . . . . 0.0 110.894 179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.627 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -78.46 -31.38 47.89 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.786 -175.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.873 HG23 ' O ' ' A' ' 13' ' ' LEU . 24.9 m -54.34 -40.77 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.622 ' CD1' ' N ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -81.71 -55.48 4.61 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -178.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 14' ' ' ILE . 0.0 OUTLIER -62.9 -24.76 67.99 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.733 -177.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -51.38 62.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.492 ' HB3' HD23 ' A' ' 30' ' ' LEU . 9.8 m-85 -81.38 -29.01 34.13 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.815 176.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 17' ' ' PHE . . . -85.88 20.25 2.28 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.121 -178.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.17 -158.74 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.495 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp 63.73 36.26 10.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 0.0 110.917 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.35 166.93 7.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 120.66 -30.6 5.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.524 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.9 m170 -108.09 -30.8 8.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.852 0.358 . . . . 0.0 110.948 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.54 144.73 0.89 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.998 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.17 81.29 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.886 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.452 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.2 p -154.25 160.99 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.196 0.522 . . . . 0.0 111.158 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.517 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -114.8 -116.73 0.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.009 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.469 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 23.1 t 179.98 130.16 0.09 Allowed 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.411 ' N ' HD23 ' A' ' 71' ' ' LEU . 8.5 ttpt -49.73 -36.34 25.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.919 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.748 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -73.99 -45.25 51.09 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 4.2 mt-10 -55.92 -29.05 59.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.972 0.415 . . . . 0.0 110.276 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.23 -26.96 63.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.913 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.748 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.28 -58.87 5.92 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.663 0.744 . . . . 0.0 110.852 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.44 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 6.3 m -55.52 -44.95 77.15 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.815 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.446 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 50.8 t80 -57.86 -27.21 63.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.044 0.45 . . . . 0.0 110.449 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.442 ' O ' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -74.15 -64.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.69 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -56.61 -19.44 16.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.032 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' A' ' 42' ' ' GLU . 12.2 t -98.52 -26.48 14.41 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.2 OUTLIER -129.9 -41.15 1.32 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.634 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.416 ' CD1' ' CE ' ' A' ' 39' ' ' MET . 14.0 mt -115.31 48.03 1.23 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.267 0.556 . . . . 0.0 110.046 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -84.5 -35.68 22.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.327 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.4 -22.72 8.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.878 0.371 . . . . 0.0 110.925 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 2.3 m-85 -88.98 -29.06 19.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.798 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -131.99 47.22 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.849 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 44' ' ' ALA . 3.4 ptmt -93.77 -49.72 5.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.245 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -114.79 22.34 13.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 50.38 26.52 2.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.235 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.94 -34.49 68.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.01 0.433 . . . . 0.0 110.568 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.455 ' CB ' HG13 ' A' ' 55' ' ' VAL . 2.5 m-20 -125.89 81.37 65.99 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.63 -10.77 29.49 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.504 2.136 . . . . 0.0 112.537 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.455 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -81.59 -24.26 56.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.704 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.463 ' CG2' ' N ' ' A' ' 56' ' ' LEU . 2.0 m -84.49 -53.66 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.987 0.422 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.463 ' N ' ' CG2' ' A' ' 55' ' ' VAL . 0.5 OUTLIER -59.72 -51.46 69.69 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.703 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.81 -26.01 65.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.666 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.02 -33.61 69.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 0.0 110.567 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.822 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -75.11 -54.3 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.648 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.523 ' N ' ' CG ' ' A' ' 59' ' ' MET . 1.9 mtm -61.66 -40.18 94.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.774 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.13 -54.36 46.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.45 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.424 ' O ' ' CD ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -80.45 2.19 26.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.492 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.405 ' CD1' ' O ' ' A' ' 63' ' ' LEU . 1.9 tm? -46.04 -29.92 1.66 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.781 0.324 . . . . 0.0 111.298 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -67.05 74.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.959 0.409 . . . . 0.0 110.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.463 ' HB2' ' HG3' ' A' ' 75' ' ' GLU . 3.6 mm? -91.09 71.02 6.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.915 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 65.69 -76.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -56.66 131.53 49.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.949 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.3 126.21 55.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.863 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 123.86 -40.15 2.02 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.505 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.452 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 -133.92 169.4 17.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.75 0.309 . . . . 0.0 111.052 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.704 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -65.8 -133.53 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.704 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 20.7 t70 160.37 165.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 118.895 0.77 . . . . 0.0 111.121 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.57 ' CG ' ' N ' ' A' ' 74' ' ' GLN . 0.7 OUTLIER -46.46 -56.45 5.92 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.265 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.57 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 23.9 tp60 -79.01 -33.25 45.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.521 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.472 ' HB2' ' HB3' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -44.79 -31.98 1.39 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.612 ' CG ' ' HB2' ' A' ' 17' ' ' PHE . 1.5 m-85 -80.51 -54.76 5.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.708 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' A' ' 81' ' ' GLY . 7.2 mt -61.69 -33.71 74.48 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.688 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.443 ' ND2' ' CD2' ' A' ' 65' ' ' LEU . 0.1 OUTLIER -71.87 -36.62 70.15 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.822 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.3 mp -65.74 -57.75 7.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.764 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.608 HG22 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -74.65 -41.99 48.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.493 179.197 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.99 51.52 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.431 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.77 -37.09 42.4 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 111.614 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.576 ' CD2' ' HE1' ' A' ' 59' ' ' MET . 5.4 mt -62.57 -47.49 83.62 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.807 0.337 . . . . 0.0 110.36 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.445 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.61 -30.8 61.53 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.361 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.544 ' CG1' ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.19 -17.34 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.787 -178.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -115.44 7.69 15.08 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.622 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -145.8 -42.79 0.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 12.7 m-70 -85.83 176.44 8.1 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.51 2.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.54 -56.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.823 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.33 -44.49 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.7 p -73.91 -24.32 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.295 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.18 -18.66 14.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.225 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 17.35 10.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.482 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.427 ' N ' ' HD3' ' A' ' 96' ' ' PRO . . . -178.4 62.15 0.15 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.039 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.47 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 46.3 Cg_exo -57.79 -46.79 24.28 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.557 2.171 . . . . 0.0 112.58 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.47 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 84.7 Cg_endo -82.8 -2.64 10.97 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.45 2.1 . . . . 0.0 112.531 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.32 89.29 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.863 0.363 . . . . 0.0 110.891 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.17 99.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -148.98 152.91 37.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 16.3 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.87 179.921 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.816 0.341 . . . . 0.0 111.289 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.12 76.17 73.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.774 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.68 -127.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.169 2.579 . . . . 0.0 112.127 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.403 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER -145.69 152.13 39.12 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.404 0.621 . . . . 0.0 111.018 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -44.9 -49.26 11.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.629 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.482 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.4 OUTLIER -62.62 -39.01 92.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.095 0.474 . . . . 0.0 109.889 179.027 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.515 ' HA ' HD11 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -51.74 -30.26 21.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.282 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.54 -27.8 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.8 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.441 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 5.6 p -75.3 -41.84 56.05 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.26 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.581 ' O ' HG13 ' B' ' 14' ' ' ILE . 1.9 mp -68.24 -53.76 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.4 . . . . 0.0 111.354 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.486 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.5 OUTLIER -51.91 -27.27 12.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.075 -178.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.518 ' O ' HG13 ' B' ' 16' ' ' VAL . 8.9 m -73.71 -56.04 5.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.875 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.6 mm? -63.48 -28.67 70.12 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.68 ' O ' ' HG3' ' B' ' 18' ' ' GLN . 14.5 mt -69.04 -38.38 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.884 0 CA-C-O 121.508 0.671 . . . . 0.0 110.881 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . 0.628 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -78.59 -31.34 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.113 -1.403 . . . . 0.0 112.744 -175.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.875 HG23 ' O ' ' B' ' 13' ' ' LEU . 25.0 m -54.38 -40.77 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -81.72 -55.41 4.65 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -178.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' B' ' 14' ' ' ILE . 0.0 OUTLIER -62.86 -24.82 67.99 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.69 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.33 -51.37 62.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.463 ' HB3' HD23 ' B' ' 30' ' ' LEU . 9.7 m-85 -81.38 -28.97 34.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.835 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.6 ' HB3' ' O ' ' B' ' 17' ' ' PHE . . . -85.89 20.29 2.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.116 -178.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.19 -158.63 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.55 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp 63.66 36.32 10.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.824 0.345 . . . . 0.0 110.922 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.53 167.1 7.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.847 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 120.59 -30.59 5.51 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.456 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -108.08 -30.8 8.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.845 0.355 . . . . 0.0 110.97 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.51 144.74 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.985 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.14 81.25 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.941 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 9.3 p -154.25 160.96 42.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.261 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.504 ' HB2' ' HB1' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -114.84 -116.75 0.32 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.997 179.474 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.47 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 23.1 t -179.99 130.24 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.421 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 8.5 ttpt -49.83 -36.27 26.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.891 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.751 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.08 -45.26 50.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.47 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 4.2 mt-10 -55.9 -28.99 59.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.352 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.19 -27.04 63.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.881 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.751 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.27 -58.92 5.73 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.616 0.722 . . . . 0.0 110.825 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' SER . . . . . 0.435 ' HB2' ' CE2' ' B' ' 20' ' ' TYR . 6.2 m -55.49 -44.86 76.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.878 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.453 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 50.6 t80 -58.01 -27.13 63.25 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.464 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.446 ' O ' ' N ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -74.19 -64.48 1.01 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.762 179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -56.57 -19.66 16.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.983 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 12.1 t -98.4 -26.36 14.5 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.2 OUTLIER -129.92 -41.19 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.414 ' CD1' ' CE ' ' B' ' 39' ' ' MET . 13.9 mt -115.35 48.07 1.23 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -84.58 -35.59 22.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.389 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.67 8.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.949 0.404 . . . . 0.0 111.008 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.437 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 2.4 m-85 -89.01 -29.0 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.782 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -132.01 47.23 2.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' B' ' 44' ' ' ALA . 3.4 ptmt -93.81 -49.69 5.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.26 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.85 22.36 13.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.011 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 50.33 26.58 2.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.214 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.97 -34.57 68.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 0.0 110.563 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.454 ' CB ' HG13 ' B' ' 55' ' ' VAL . 2.5 m-20 -125.79 81.39 65.61 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.423 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.62 -10.78 29.54 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.573 2.182 . . . . 0.0 112.573 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.461 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -81.59 -24.3 56.5 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.731 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.469 ' CG2' ' N ' ' B' ' 56' ' ' LEU . 2.0 m -84.54 -53.51 10.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.858 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.469 ' N ' ' CG2' ' B' ' 55' ' ' VAL . 0.5 OUTLIER -59.74 -51.38 70.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.755 -179.535 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -67.88 -26.08 65.83 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.575 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -57.93 -33.66 69.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.848 0.356 . . . . 0.0 110.607 -179.87 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.819 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.18 -54.26 7.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.581 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.532 ' N ' ' CG ' ' B' ' 59' ' ' MET . 1.9 mtm -61.63 -40.25 94.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.1 -54.27 47.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.486 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.417 ' CD ' ' O ' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -80.54 2.12 26.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.488 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.407 ' O ' ' CD1' ' B' ' 63' ' ' LEU . 1.9 tm? -45.98 -29.95 1.63 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.87 0.367 . . . . 0.0 111.269 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -67.03 74.3 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.833 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.478 ' HB2' ' HG3' ' B' ' 75' ' ' GLU . 3.6 mm? -91.11 71.11 6.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.854 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 65.73 -76.42 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.992 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -56.62 131.48 49.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.29 126.24 55.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 123.87 -40.17 2.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.567 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.444 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.1 mm-40 -134.02 169.39 17.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 111.04 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.706 ' O ' ' HB2' ' B' ' 72' ' ' ASP . 0.1 OUTLIER -65.76 -133.48 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.706 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 20.7 t70 160.36 165.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 118.93 0.786 . . . . 0.0 111.079 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.562 ' CG ' ' N ' ' B' ' 74' ' ' GLN . 0.7 OUTLIER -46.43 -56.4 5.97 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.303 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.562 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 23.6 tp60 -79.07 -33.25 44.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.489 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.485 ' HB2' ' HB3' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -44.8 -31.97 1.4 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.872 0.368 . . . . 0.0 110.317 179.361 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.601 ' CG ' ' HB2' ' B' ' 17' ' ' PHE . 1.5 m-85 -80.49 -54.62 5.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.787 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' B' ' 81' ' ' GLY . 7.2 mt -61.72 -33.76 74.6 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.716 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.442 ' ND2' ' CD2' ' B' ' 65' ' ' LEU . 0.1 OUTLIER -71.86 -36.7 70.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.819 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.3 mp -65.67 -57.7 7.45 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.608 HG22 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -74.74 -41.85 47.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.781 0.324 . . . . 0.0 110.496 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -49.95 52.3 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.423 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.74 -37.08 42.1 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.64 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.569 ' CD2' ' HE1' ' B' ' 59' ' ' MET . 5.4 mt -62.69 -47.43 83.68 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.463 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.62 -30.7 61.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.172 0.511 . . . . 0.0 111.461 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.555 ' CG1' ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.37 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.785 -179.02 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . 0.403 ' CB ' ' HB ' ' B' ' 55' ' ' VAL . . . -115.49 7.71 15.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.533 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.437 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -145.72 -42.78 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.009 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.463 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.8 m-70 -85.9 176.41 8.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.42 2.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.45 -56.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.871 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -125.37 -44.45 1.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.878 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -73.94 -24.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.18 -18.66 14.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.262 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.82 17.47 10.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.469 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.419 ' N ' ' HD3' ' B' ' 96' ' ' PRO . . . -178.46 62.1 0.15 Allowed Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.46 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 47.1 Cg_exo -57.72 -46.91 23.68 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.602 2.201 . . . . 0.0 112.53 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.46 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 84.3 Cg_endo -82.73 -2.66 11.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.409 2.073 . . . . 0.0 112.576 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.26 89.31 3.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.906 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.14 99.53 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -148.98 152.99 37.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.889 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 15.9 t80 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.929 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.796 0.331 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -131.71 118.12 16.61 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.885 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.56 -101.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.699 2.266 . . . . 0.0 112.193 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.414 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -160.94 146.52 14.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.394 0.616 . . . . 0.0 111.207 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -44.04 9.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.348 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.474 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.5 m -68.67 -38.15 80.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.275 179.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.414 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.2 OUTLIER -52.04 -37.13 52.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.68 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.38 -26.77 41.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.816 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.446 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.8 OUTLIER -68.65 -47.34 66.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.392 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.514 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.1 mp -61.01 -57.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.69 0.281 . . . . 0.0 111.066 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.48 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -53.84 -27.57 30.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.183 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.444 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -62.7 -55.5 26.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.781 -179.54 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.825 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.1 mm? -71.35 -41.76 69.36 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.0 mt -56.11 -29.33 26.97 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 CA-C-O 121.083 0.468 . . . . 0.0 112.128 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.14 -32.89 21.06 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.526 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.825 HG21 ' O ' ' A' ' 13' ' ' LEU . 14.2 m -54.7 -31.4 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 76' ' ' PHE . 1.1 m-85 -80.34 -58.09 3.3 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.335 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.755 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.9 mm-40 -48.5 -30.86 5.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.6 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -61.96 -51.36 68.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.866 0.365 . . . . 0.0 110.505 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -80.42 -32.95 37.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.748 0.785 . . . . 0.0 109.563 178.312 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.496 ' N ' ' HG ' ' A' ' 30' ' ' LEU . . . -90.4 19.9 4.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.854 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -164.9 -164.76 20.94 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.399 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -177.44 -66.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.811 0.338 . . . . 0.0 110.967 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -163.24 31.35 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.55 130.23 1.29 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.569 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.9 104.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 0.0 111.012 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -146.55 81.45 1.57 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.71 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 p -105.91 -23.94 4.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.402 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.429 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 37.5 p -140.26 -176.51 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.193 0.521 . . . . 0.0 111.357 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' HG ' ' N ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -135.38 -129.07 0.15 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.177 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.418 ' CB ' ' HB2' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -173.86 131.06 0.41 Allowed 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.53 -42.58 44.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 0.0 110.619 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.825 ' HA ' ' CD2' ' A' ' 36' ' ' LEU . 1.9 m -75.2 -43.12 53.75 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.192 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.418 ' HB2' ' CB ' ' A' ' 31' ' ' SER . 3.1 mt-10 -55.28 -28.87 56.39 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.403 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.7 19.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.091 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.825 ' CD2' ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.7 62.12 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.089 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.443 ' N ' ' O ' ' A' ' 33' ' ' THR . 2.2 t -81.4 -53.81 5.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.272 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.506 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 0.3 OUTLIER -62.31 -36.02 80.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.296 179.494 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.428 ' HG3' ' CB ' ' A' ' 43' ' ' LEU . 4.2 ttm -46.67 -36.94 7.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.128 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -64.0 -19.33 65.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.186 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.438 ' CG2' ' CG ' ' A' ' 42' ' ' GLU . 4.6 t -84.12 -30.71 25.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.438 ' CG ' ' CG2' ' A' ' 41' ' ' THR . 1.0 OUTLIER -135.35 -38.01 0.76 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.191 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.43 HD23 ' CD1' ' A' ' 46' ' ' PHE . 19.0 mt -104.65 36.09 2.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.39 0.614 . . . . 0.0 110.146 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.24 35.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.11 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.75 -24.23 14.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.821 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.468 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 3.1 m-85 -100.27 27.11 5.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.784 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.5 p -152.11 -42.41 0.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.059 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.79 -83.82 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.708 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -93.5 -56.17 3.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.964 0.411 . . . . 0.0 110.333 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 55.18 168.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.522 179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -108.33 -28.89 9.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.491 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.417 ' HB2' HG23 ' A' ' 55' ' ' VAL . 23.2 m-20 -121.08 116.09 31.37 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.777 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -66.03 -7.11 16.02 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.556 2.171 . . . . 0.0 112.683 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.75 -19.73 55.59 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.119 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.417 HG23 ' HB2' ' A' ' 52' ' ' ASP . 85.6 t -49.27 -54.85 5.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.968 0.384 . . . . 0.0 111.285 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.496 ' HG ' ' CE ' ' A' ' 60' ' ' MET . 0.1 OUTLIER -69.39 -51.61 34.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.298 0.57 . . . . 0.0 110.208 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' A' ' 61' ' ' LYS . 2.9 t0 -54.6 -26.71 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.607 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.99 -53.03 62.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.663 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.796 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 2.5 ptp -60.54 -53.73 53.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.01 0.433 . . . . 0.0 110.456 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.604 ' HE1' ' HG2' ' A' ' 59' ' ' MET . 2.3 mtm -60.32 -32.43 71.23 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.757 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.4 ' CG ' ' O ' ' A' ' 57' ' ' ASP . 8.2 mtpp -73.83 -57.35 4.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.881 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.8 mmtm -80.25 6.18 12.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.574 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -15.92 15.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.479 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -67.99 66.33 0.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.931 0.395 . . . . 0.0 110.888 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 75' ' ' GLU . 3.3 mm? -89.91 -44.93 9.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.374 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.08 108.81 6.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.768 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t -72.33 73.74 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.34 -28.82 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.012 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 134.28 -30.42 2.91 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.342 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.536 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.4 OUTLIER -122.39 -171.29 2.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.487 0.184 . . . . 0.0 110.609 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.533 HD11 HD21 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -63.71 -140.45 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.51 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.6 OUTLIER 165.61 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.256 0.55 . . . . 0.0 111.392 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.634 ' HB2' ' CG1' ' B' ' 85' ' ' VAL . 0.8 OUTLIER -46.05 -61.81 1.6 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.585 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.18 -30.43 38.81 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.267 -179.35 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.527 ' HB3' ' CD1' ' A' ' 71' ' ' LEU . 0.4 OUTLIER -46.58 -31.35 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.784 179.397 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.554 ' HB3' ' CD1' ' A' ' 17' ' ' PHE . 0.8 OUTLIER -79.36 -54.38 6.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.771 178.332 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.509 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 6.3 mt -61.07 -34.04 74.28 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.617 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.507 ' HB2' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -72.38 -34.57 68.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.054 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.796 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 0.3 OUTLIER -67.83 -57.83 5.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.685 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.615 HG23 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -74.27 -43.77 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.112 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -53.02 -50.35 51.66 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.42 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.81 -37.32 43.25 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.659 177.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 7.6 mt -64.01 -45.46 88.85 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.737 0.303 . . . . 0.0 110.219 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.438 ' HA ' ' CD2' ' A' ' 88' ' ' HIS . . . -55.25 -32.75 62.58 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.338 0.59 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.627 ' CG1' ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.48 9.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.666 -179.487 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.32 12.08 18.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.299 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.92 -39.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.677 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.468 ' NE2' ' CE2' ' A' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.61 12.26 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.774 0.321 . . . . 0.0 111.19 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.7 89.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.152 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.1 m 176.55 107.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.664 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 75.88 -48.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 31.2 m -44.41 -29.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.885 0.374 . . . . 0.0 111.654 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.94 -39.58 15.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.03 28.91 4.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.406 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.452 ' CB ' ' CD ' ' A' ' 96' ' ' PRO . . . -73.15 -65.82 0.63 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.162 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.577 ' HG2' ' HD3' ' A' ' 97' ' ' PRO . 1.9 Cg_endo -39.08 -55.52 1.43 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.38 2.72 . . . . 0.0 113.221 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.577 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 81.0 Cg_exo -42.71 -39.22 7.09 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.514 2.143 . . . . 0.0 112.731 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.58 -31.85 64.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.4 tttt 60.27 -169.0 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.835 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -149.38 174.79 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.915 -179.949 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.805 0.336 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -131.74 118.17 16.59 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.845 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.52 -101.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.807 2.338 . . . . 0.0 112.192 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.415 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -161.03 146.48 14.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.392 0.615 . . . . 0.0 111.171 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -43.95 9.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.326 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.479 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.5 m -68.77 -38.08 79.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.277 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.2 OUTLIER -52.12 -37.04 52.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.667 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -26.88 42.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.802 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.437 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.8 OUTLIER -68.65 -47.39 66.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.397 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.512 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.1 mp -60.96 -56.9 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 120.768 0.318 . . . . 0.0 111.132 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.466 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -54.0 -27.51 32.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.19 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.446 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 0.2 OUTLIER -62.67 -55.54 25.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.817 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.819 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.1 mm? -71.37 -41.72 69.36 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.742 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 mt -56.1 -29.3 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 121.913 -0.492 . . . . 0.0 112.136 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.13 -32.84 21.09 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.554 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.819 HG21 ' O ' ' B' ' 13' ' ' LEU . 14.4 m -54.74 -31.4 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.558 ' CD1' ' HB3' ' B' ' 76' ' ' PHE . 1.1 m-85 -80.28 -58.16 3.27 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.373 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.742 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.9 mm-40 -48.56 -30.73 5.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.622 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -62.06 -51.31 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.873 0.368 . . . . 0.0 110.495 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.502 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 0.2 OUTLIER -80.31 -33.05 37.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.804 0.812 . . . . 0.0 109.631 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.502 ' N ' ' HG ' ' B' ' 30' ' ' LEU . . . -90.42 20.04 4.8 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.213 -1.358 . . . . 0.0 111.743 -178.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -165.02 -164.75 21.05 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.406 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -177.44 -66.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.351 . . . . 0.0 110.994 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -163.25 31.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.58 130.35 1.3 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.541 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.77 104.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.86 0.362 . . . . 0.0 110.975 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -146.6 81.49 1.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 p -105.93 -23.91 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.361 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 37.5 p -140.22 -176.4 4.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.363 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.502 ' HG ' ' N ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -135.48 -129.14 0.15 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.183 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.416 ' CB ' ' HB2' ' B' ' 34' ' ' GLU . 0.0 OUTLIER -173.82 131.04 0.42 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.49 -42.62 43.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.82 0.343 . . . . 0.0 110.643 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.824 ' HA ' ' CD2' ' B' ' 36' ' ' LEU . 1.9 m -75.18 -43.14 53.87 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.256 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' B' ' 38' ' ' PHE . 3.1 mt-10 -55.13 -28.98 56.62 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.401 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.72 19.44 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.038 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.824 ' CD2' ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.84 62.15 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.987 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' SER . . . . . 0.409 ' N ' ' O ' ' B' ' 33' ' ' THR . 2.1 t -81.31 -53.8 6.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.309 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.502 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -62.44 -35.86 80.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.363 179.553 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.44 ' HG3' ' CB ' ' B' ' 43' ' ' LEU . 4.1 ttm -46.79 -36.87 7.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.005 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -64.01 -19.46 65.2 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.444 ' CG2' ' CG ' ' B' ' 42' ' ' GLU . 4.5 t -83.94 -30.82 25.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.444 ' CG ' ' CG2' ' B' ' 41' ' ' THR . 1.0 OUTLIER -135.4 -37.94 0.76 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -178.118 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.44 ' CB ' ' HG3' ' B' ' 39' ' ' MET . 19.0 mt -104.68 36.07 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.41 0.624 . . . . 0.0 110.184 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.37 -38.23 35.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.14 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.69 -24.32 14.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.805 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.459 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 3.1 m-85 -100.25 27.12 5.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.77 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 82.6 p -152.1 -42.42 0.11 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.042 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.83 -83.88 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.691 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -93.36 -56.22 3.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.968 0.413 . . . . 0.0 110.369 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 55.27 168.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.462 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -108.34 -28.8 9.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.401 ' HB2' HG23 ' B' ' 55' ' ' VAL . 23.6 m-20 -121.09 116.22 31.29 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.762 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -66.06 -7.11 16.09 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.571 2.18 . . . . 0.0 112.649 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.76 -19.7 55.66 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.087 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.401 HG23 ' HB2' ' B' ' 52' ' ' ASP . 86.6 t -49.38 -54.84 5.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 117.019 0.409 . . . . 0.0 111.261 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.492 ' HG ' ' CE ' ' B' ' 60' ' ' MET . 0.1 OUTLIER -69.35 -51.72 34.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 110.175 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.4 ' O ' ' CG ' ' B' ' 61' ' ' LYS . 2.9 t0 -54.5 -26.85 33.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.9 -53.08 62.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.617 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.78 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 2.5 ptp -60.56 -53.8 53.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.373 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.615 ' HE1' ' HG2' ' B' ' 59' ' ' MET . 2.2 mtm -60.26 -32.44 71.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.75 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.4 ' CG ' ' O ' ' B' ' 57' ' ' ASP . 8.2 mtpp -73.91 -57.32 4.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 26.8 mmtm -80.24 6.21 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.585 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.02 -15.85 15.41 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.514 0.191 . . . . 0.0 111.514 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -68.05 66.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.919 0.39 . . . . 0.0 110.901 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.529 HD23 ' HA ' ' B' ' 75' ' ' GLU . 3.3 mm? -89.85 -44.9 9.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.361 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.06 108.88 6.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.804 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -72.38 73.82 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.005 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.34 -29.01 6.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.013 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 134.3 -30.31 2.93 Favored Glycine 0 C--N 1.33 0.221 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.299 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.553 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER -122.51 -171.21 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.485 0.183 . . . . 0.0 110.536 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.54 HD11 HD21 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -63.7 -140.45 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.506 ' O ' ' CE2' ' B' ' 76' ' ' PHE . 0.6 OUTLIER 165.66 175.7 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.177 0.513 . . . . 0.0 111.428 178.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.627 ' HB2' ' CG1' ' A' ' 85' ' ' VAL . 0.9 OUTLIER -46.04 -61.8 1.6 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -177.639 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.582 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.29 -30.42 38.28 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.211 -179.266 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.529 ' HA ' HD23 ' B' ' 65' ' ' LEU . 0.4 OUTLIER -46.45 -31.49 2.72 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.873 179.331 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.558 ' HB3' ' CD1' ' B' ' 17' ' ' PHE . 0.8 OUTLIER -79.18 -54.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 120.462 -0.495 . . . . 0.0 109.818 178.242 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.519 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 6.3 mt -60.96 -34.02 74.11 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.716 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.509 ' HB2' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -72.44 -34.55 67.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.043 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.78 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 0.3 OUTLIER -67.86 -57.82 5.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.645 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.597 HG23 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -74.23 -43.77 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.135 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.1 -50.34 52.0 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.426 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.86 -37.34 43.67 Favored Glycine 0 CA--C 1.52 0.405 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.633 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 7.7 mt -64.02 -45.34 89.34 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.773 0.321 . . . . 0.0 110.253 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.442 ' HA ' ' CD2' ' B' ' 88' ' ' HIS . . . -55.32 -32.78 62.76 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.3 0.572 . . . . 0.0 110.663 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.634 ' CG1' ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.34 -17.29 9.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.727 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.41 12.1 18.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.368 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.89 -39.66 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.678 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.459 ' NE2' ' CE2' ' B' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.63 12.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.819 0.343 . . . . 0.0 111.143 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.69 89.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.154 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.1 m 176.54 107.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.626 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . 0.401 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 75.91 -49.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.156 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 30.9 m -44.38 -29.55 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.862 0.363 . . . . 0.0 111.663 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -39.58 15.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.093 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.04 28.88 4.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.381 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.443 ' CB ' ' CD ' ' B' ' 96' ' ' PRO . . . -73.1 -65.79 0.64 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.216 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.572 ' HG2' ' HD3' ' B' ' 97' ' ' PRO . 1.9 Cg_endo -39.12 -55.52 1.44 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.483 2.789 . . . . 0.0 113.193 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.572 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 80.6 Cg_exo -42.78 -39.24 7.26 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.648 2.232 . . . . 0.0 112.689 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -31.94 64.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.5 tttt 60.29 -168.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.861 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -149.34 174.76 12.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.876 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.203 -0.904 . . . . 0.0 110.894 -179.996 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.787 0.327 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.427 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -135.77 91.12 18.24 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 2' ' ' ARG . 22.7 Cg_endo -55.62 -83.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.915 2.41 . . . . 0.0 112.832 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -109.93 146.64 34.86 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.482 0.658 . . . . 0.0 111.392 -179.804 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 6' ' ' THR . 0.7 OUTLIER -45.01 -48.24 11.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.303 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.522 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 19.7 m -65.26 -39.7 92.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.385 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 4' ' ' THR . 1.3 mm-40 -51.76 -45.91 63.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.498 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -26.78 60.93 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.534 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 0.2 OUTLIER -63.6 -52.31 61.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.956 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.595 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -55.69 -57.12 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 120.694 0.283 . . . . 0.0 111.056 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.481 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.8 OUTLIER -54.59 -27.42 38.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.025 0.44 . . . . 0.0 110.756 179.5 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.541 ' CB ' ' HB2' ' B' ' 9' ' ' CYS . 0.1 OUTLIER -63.07 -55.51 24.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.081 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.892 ' O ' HG23 ' A' ' 16' ' ' VAL . 4.0 mm? -72.14 -30.97 65.55 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.762 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.5 mt -69.8 -38.25 75.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 111.95 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.65 64.06 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.678 -1.147 . . . . 0.0 112.023 -176.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 13' ' ' LEU . 15.9 m -52.27 -40.0 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.615 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 31.3 t80 -72.85 -58.21 3.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.296 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.762 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.0 mm-40 -49.09 -49.02 43.74 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -51.28 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.525 -178.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.442 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.6 m-85 -80.59 -26.87 37.61 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.59 0.709 . . . . 0.0 110.206 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.615 ' HB1' ' O ' ' A' ' 17' ' ' PHE . . . -90.39 20.07 4.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.781 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -121.21 90.81 0.46 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.556 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.39 43.3 2.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.845 0.355 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.45 114.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.07 156.1 28.05 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.552 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 66.08 -75.55 0.05 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.789 0.328 . . . . 0.0 111.014 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 61.22 19.38 10.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.232 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.8 m -144.25 17.63 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.361 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 24.1 p -155.17 -176.91 6.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.989 0.423 . . . . 0.0 110.812 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.465 ' HB2' ' CE1' ' A' ' 17' ' ' PHE . 0.3 OUTLIER -147.78 -123.16 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.261 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -173.7 129.23 0.41 Allowed 'General case' 0 C--O 1.231 0.088 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.408 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -49.91 -40.71 44.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.165 -179.136 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.696 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.44 -42.72 67.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.936 0.398 . . . . 0.0 110.041 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.428 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 3.0 mt-10 -56.01 -29.65 60.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -68.62 -34.88 76.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.535 178.441 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.696 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -53.37 -59.08 5.03 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.699 0.761 . . . . 0.0 111.192 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.433 ' O ' HG21 ' A' ' 41' ' ' THR . 3.0 t -57.88 -27.75 63.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.34 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.428 ' O ' HG21 ' A' ' 41' ' ' THR . 8.7 t80 -57.69 -50.39 73.35 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.012 0.434 . . . . 0.0 110.267 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.481 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.39 -44.14 95.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.444 0.64 . . . . 0.0 110.107 179.05 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.44 -19.29 64.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.932 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 37' ' ' SER . 8.3 t -107.61 -52.69 2.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -128.09 29.2 5.42 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -177.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.8 mt -166.7 45.8 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.17 0.51 . . . . 0.0 110.604 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.427 ' O ' ' N ' ' A' ' 48' ' ' LYS . . . -74.87 -30.0 61.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.361 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.47 -29.49 61.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.879 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -83.28 -4.63 58.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.409 ' CG2' ' HB3' ' A' ' 39' ' ' MET . 1.4 p -127.16 -11.23 5.86 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.668 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 44' ' ' ALA . 9.2 mttp -59.59 139.75 56.92 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 110.758 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 78.81 -47.83 0.42 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.005 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.17 26.71 4.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 110.98 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -66.54 -31.99 73.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.512 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.93 86.69 9.29 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.657 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -83.41 37.58 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.838 2.359 . . . . 0.0 112.835 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.566 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -135.54 4.33 4.03 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.947 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 48.9 t -85.22 -63.5 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.918 0.39 . . . . 0.0 111.523 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.411 HD12 ' HG2' ' A' ' 39' ' ' MET . 7.0 tt -75.16 -52.15 11.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.969 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 1.6 t0 -55.48 -26.81 44.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.028 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.566 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -66.57 -53.79 30.68 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -179.329 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.665 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -75.55 -43.09 50.41 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.11 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.412 ' HA ' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -64.43 -45.38 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.664 -179.251 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 47.0 mmtt -70.53 -52.06 24.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.98 0.419 . . . . 0.0 110.479 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -80.36 6.47 12.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.341 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' A' ' 59' ' ' MET . 1.2 pt? -44.7 -26.65 0.4 Allowed 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -70.94 64.51 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.889 0.376 . . . . 0.0 110.48 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.63 -39.59 6.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.031 -179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -115.67 -40.41 3.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.35 -178.64 5.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.765 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -146.13 34.15 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.883 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.31 -79.6 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.505 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 1.5 mm-40 -87.33 179.63 6.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.891 0.377 . . . . 0.0 111.109 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.457 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER -69.37 -137.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.633 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 2.5 t70 173.72 161.49 0.16 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.466 0.575 . . . . 0.0 110.879 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.53 ' HB2' HG13 ' B' ' 85' ' ' VAL . 51.5 p90 -55.39 -58.85 6.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.289 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -79.96 -22.59 42.44 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 119.824 -0.751 . . . . 0.0 110.516 -179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.832 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.5 mt-10 -44.76 -38.09 4.22 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.506 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 1.4 t80 -76.84 -54.71 6.25 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 177.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.484 HD12 HD12 ' B' ' 77' ' ' LEU . 0.0 OUTLIER -48.55 -33.94 10.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.599 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -76.38 -52.39 9.99 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.686 178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.974 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -58.5 -59.07 5.95 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.951 -179.073 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.477 HG23 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.24 -41.41 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 O-C-N 123.606 0.566 . . . . 0.0 111.212 179.492 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.457 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.83 -50.82 48.55 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 119.68 -1.247 . . . . 0.0 110.22 178.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -60.71 -35.91 90.66 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 120.455 -0.879 . . . . 0.0 111.846 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.974 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.8 mt -63.92 -38.32 90.66 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.403 ' HB2' ' CD1' ' B' ' 14' ' ' ILE . . . -55.3 -35.73 65.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.095 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.529 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.81 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.67 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.86 16.14 18.46 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.163 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.406 ' N ' ' O ' ' A' ' 83' ' ' LEU . 45.1 t -162.76 -42.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.825 -179.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.525 ' HB3' HD13 ' B' ' 14' ' ' ILE . 0.6 OUTLIER -99.01 78.78 2.29 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 111.855 -179.013 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 90' ' ' SER . 6.0 mp0 53.37 -163.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.292 179.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 3.2 m 81.7 -69.56 0.08 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.247 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.57 -37.52 4.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.054 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m -65.29 -27.08 41.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.42 -29.01 15.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.89 -30.18 70.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.116 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -154.86 66.85 5.15 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.037 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.45 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 50.7 Cg_exo -57.49 -47.16 23.04 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.761 2.308 . . . . 0.0 112.569 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.45 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 98.0 Cg_endo -79.96 -25.34 5.19 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.358 2.039 . . . . 0.0 112.368 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.75 85.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.933 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.65 168.04 2.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.7 -62.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.805 0.336 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.42 ' HA ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -135.74 91.1 18.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.921 179.984 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' B' ' 2' ' ' ARG . 22.3 Cg_endo -55.74 -83.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.905 2.403 . . . . 0.0 112.834 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -109.85 146.51 34.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.429 0.633 . . . . 0.0 111.476 -179.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' B' ' 6' ' ' THR . 0.7 OUTLIER -44.96 -48.25 11.4 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.255 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.524 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 20.1 m -65.31 -39.69 92.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.326 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 4' ' ' THR . 1.3 mm-40 -51.74 -45.87 63.83 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.458 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -26.77 60.86 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.541 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -63.48 -52.41 61.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.032 179.791 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.601 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -55.6 -57.07 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.638 0.256 . . . . 0.0 111.117 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.5 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.8 OUTLIER -54.67 -27.43 40.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 110.729 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.534 ' CB ' ' HB2' ' A' ' 9' ' ' CYS . 0.1 OUTLIER -63.05 -55.52 24.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.084 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.896 ' O ' HG23 ' B' ' 16' ' ' VAL . 4.0 mm? -72.16 -31.02 65.56 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.758 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.6 mt -69.8 -38.2 75.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.344 0.592 . . . . 0.0 111.902 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.18 -34.58 63.82 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.963 -176.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.896 HG23 ' O ' ' B' ' 13' ' ' LEU . 16.0 m -52.27 -40.07 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 177.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.632 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 31.4 t80 -72.77 -58.1 3.6 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.422 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.758 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.0 mm-40 -49.32 -48.84 46.04 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.28 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.66 -51.25 22.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.511 -178.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.441 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.6 m-85 -80.53 -26.9 37.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.521 0.677 . . . . 0.0 110.144 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.632 ' HB1' ' O ' ' B' ' 17' ' ' PHE . . . -90.4 20.03 4.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.705 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -121.11 90.73 0.46 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.594 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.5 43.43 2.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.411 . . . . 0.0 110.911 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.27 114.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.971 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.09 156.0 28.01 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.646 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 66.09 -75.66 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.719 0.295 . . . . 0.0 110.972 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 61.37 19.34 10.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.6 m -144.21 17.69 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.402 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 24.2 p -155.16 -176.98 6.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.016 0.436 . . . . 0.0 110.839 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.468 ' HB2' ' CE1' ' B' ' 17' ' ' PHE . 0.3 OUTLIER -147.74 -123.2 0.06 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.31 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -173.66 129.21 0.42 Allowed 'General case' 0 C--O 1.231 0.116 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.413 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -49.8 -40.79 42.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.19 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.711 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.34 -42.77 68.12 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.075 179.591 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 3.0 mt-10 -55.92 -29.77 60.58 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -68.57 -34.86 76.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.521 178.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.711 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -53.4 -59.12 4.99 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 111.123 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' SER . . . . . 0.43 ' O ' HG21 ' B' ' 41' ' ' THR . 3.0 t -57.84 -27.74 63.47 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.386 -178.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.422 ' O ' HG21 ' B' ' 41' ' ' THR . 8.6 t80 -57.64 -50.49 72.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.979 0.418 . . . . 0.0 110.26 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.498 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -60.32 -44.07 95.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.438 0.637 . . . . 0.0 110.147 179.064 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -63.5 -19.29 64.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.92 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.43 HG21 ' O ' ' B' ' 37' ' ' SER . 8.2 t -107.68 -52.59 2.74 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' B' ' 43' ' ' LEU . 0.9 OUTLIER -128.16 29.2 5.41 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.158 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 7.8 mt -166.7 45.81 0.06 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.138 0.494 . . . . 0.0 110.604 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' B' ' 48' ' ' LYS . . . -74.83 -29.95 61.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.431 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.49 -29.5 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.856 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -83.32 -4.61 58.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.201 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.407 ' CG2' ' HB3' ' B' ' 39' ' ' MET . 1.4 p -127.1 -11.19 5.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.705 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' B' ' 44' ' ' ALA . 9.3 mttp -59.55 139.7 56.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 78.84 -47.84 0.42 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.16 26.71 4.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.001 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -66.56 -32.07 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.89 86.63 9.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.645 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.43 37.65 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.799 2.333 . . . . 0.0 112.809 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.576 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -135.56 4.32 4.02 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.964 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t -85.27 -63.42 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 0.0 111.534 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.406 ' CD2' ' C ' ' B' ' 56' ' ' LEU . 7.0 tt -75.11 -52.23 11.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.976 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 1.6 t0 -55.52 -26.77 44.91 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.02 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.576 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -66.59 -53.75 31.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.676 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -75.53 -43.09 50.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.404 ' HA ' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -64.47 -45.28 88.04 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.683 -179.234 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 47.1 mmtt -70.61 -52.04 24.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -80.42 6.55 11.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.406 ' CD1' HD21 ' B' ' 71' ' ' LEU . 1.2 pt? -44.68 -26.63 0.4 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -70.97 64.5 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.934 0.397 . . . . 0.0 110.469 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.71 -39.48 6.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.047 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -115.7 -40.53 3.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.18 -178.57 5.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.84 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -146.18 34.11 0.99 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.855 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.18 -79.59 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.552 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.417 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 1.5 mm-40 -87.29 179.56 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.88 0.372 . . . . 0.0 111.167 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.459 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.4 OUTLIER -69.25 -137.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.632 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 2.5 t70 173.69 161.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.409 0.55 . . . . 0.0 110.969 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.529 ' HB2' HG13 ' A' ' 85' ' ' VAL . 51.6 p90 -55.37 -58.83 6.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.4 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.584 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.2 OUTLIER -79.92 -22.55 42.59 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.556 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.826 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.5 mt-10 -44.81 -38.11 4.29 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 1.4 t80 -76.77 -54.71 6.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.484 HD12 HD12 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -48.6 -33.85 10.54 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 177.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -76.48 -52.36 9.96 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.654 178.027 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.969 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -58.55 -58.94 6.35 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.977 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.483 HG23 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -72.27 -41.53 65.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 O-C-N 123.572 0.545 . . . . 0.0 111.158 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.454 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.72 -50.82 47.87 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 119.75 -1.215 . . . . 0.0 110.261 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -60.77 -35.88 90.77 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.847 177.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.969 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.9 mt -63.87 -38.35 90.77 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.58 65.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.098 178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.53 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.54 -17.89 9.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 114.732 -1.122 . . . . 0.0 111.706 -179.538 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.78 15.98 18.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.13 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.416 ' N ' ' O ' ' B' ' 83' ' ' LEU . 45.3 t -162.74 -42.41 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.852 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.515 ' HB3' HD13 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -99.12 78.86 2.28 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.923 0.392 . . . . 0.0 111.869 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' B' ' 90' ' ' SER . 6.0 mp0 53.37 -163.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.415 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' SER . . . . . 0.417 ' HB2' HG11 ' B' ' 85' ' ' VAL . 3.2 m 81.72 -69.64 0.08 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.241 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.51 -37.52 4.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.103 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m -65.34 -27.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.364 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.41 -28.95 15.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.006 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.98 -30.13 70.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.059 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -154.86 66.8 5.14 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.038 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.449 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 50.2 Cg_exo -57.5 -47.12 23.17 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.763 2.309 . . . . 0.0 112.622 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.449 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 98.2 Cg_endo -80.01 -25.3 5.16 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.336 2.024 . . . . 0.0 112.324 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.78 85.04 0.21 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.64 168.15 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.835 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.75 -62.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.929 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.487 1.425 0 CA-C-O 120.765 0.317 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.425 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 1.3 mtp180 -89.96 -51.66 0.34 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.032 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 24.9 Cg_exo -67.82 -131.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.949 2.433 . . . . 0.0 111.846 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.425 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -172.6 147.01 1.77 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.328 0.585 . . . . 0.0 111.049 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.76 -46.44 10.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.114 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.507 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.19 -41.76 96.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.18 0.514 . . . . 0.0 109.932 179.057 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 1.5 mt-10 -51.66 -34.71 39.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.37 -35.43 40.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.842 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.434 ' SG ' HD22 ' B' ' 13' ' ' LEU . 3.4 p -65.45 -40.7 93.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.066 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.61 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.6 mp -69.89 -56.17 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.402 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.488 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.1 -27.47 14.18 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.604 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.554 ' O ' HG13 ' A' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.887 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.913 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.9 mm? -59.75 -29.67 68.33 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.118 0.485 . . . . 0.0 112.086 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 8.0 mt -70.66 -39.04 75.37 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 CA-C-O 121.541 0.686 . . . . 0.0 110.539 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.5 -32.79 58.53 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.293 -176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.913 HG21 ' O ' ' A' ' 13' ' ' LEU . 25.0 m -52.09 -39.09 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 9.1 t80 -77.85 -58.47 3.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.917 179.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.755 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.6 mm-40 -48.84 -30.97 6.39 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -51.56 68.95 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.804 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.459 ' HB3' HD23 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.05 -49.38 10.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.794 0.807 . . . . 0.0 109.962 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.551 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -57.25 -52.12 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.782 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -168.22 2.61 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.53 104.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.787 0.327 . . . . 0.0 110.885 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 60.68 156.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.17 155.59 31.82 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.474 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -99.83 163.06 12.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.835 0.35 . . . . 0.0 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m 62.43 151.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.9 m -84.74 60.87 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 31.7 p -123.57 -178.33 3.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.262 0.553 . . . . 0.0 111.031 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.551 ' HG ' ' CA ' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -131.73 -139.86 0.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.787 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.437 ' N ' HD21 ' A' ' 30' ' ' LEU . 1.3 p -164.33 136.72 4.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 3.4 pttt -49.72 -35.76 23.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.925 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.825 ' HA ' ' CD2' ' A' ' 36' ' ' LEU . 12.9 m -74.28 -53.18 10.26 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.856 -0.338 . . . . 0.0 111.779 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 20' ' ' TYR . 25.4 mt-10 -55.63 -28.2 53.96 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.54 ' CE2' ' CD2' ' A' ' 76' ' ' PHE . 1.3 t80 -78.18 -43.02 29.73 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.209 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.825 ' CD2' ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -68.23 -21.02 64.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.48 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -80.99 -26.55 36.42 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.141 0.496 . . . . 0.0 109.831 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.458 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 45.8 t80 -69.5 -24.48 63.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.666 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.418 ' O ' ' C ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -72.44 -41.68 65.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.615 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.99 -19.4 60.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.4 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.4 p -106.32 -76.53 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 38' ' ' PHE . 2.0 mm-40 -68.41 -33.15 73.71 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.422 HD11 HD13 ' A' ' 83' ' ' LEU . 15.5 mt -121.95 43.73 2.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.074 0.464 . . . . 0.0 110.686 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.68 -25.02 58.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.809 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.08 -23.23 67.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.812 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -95.55 -27.89 15.13 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.915 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -125.26 42.59 3.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.839 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.06 -71.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.974 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -89.09 9.81 24.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.455 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 57.22 38.37 28.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.88 0.371 . . . . 0.0 110.997 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -37.67 67.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.944 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.75 101.91 15.28 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.754 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -70.34 -0.87 8.03 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.798 2.332 . . . . 0.0 112.943 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.543 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -100.38 2.03 56.12 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.707 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.6 t -84.76 -61.86 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.066 0.46 . . . . 0.0 111.437 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.8 tp -75.1 -51.23 13.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.735 -179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.65 -33.76 64.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.489 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -64.27 -40.31 95.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.694 -179.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.539 ' CG ' ' N ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -61.69 -54.21 45.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.041 0.448 . . . . 0.0 111.199 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.539 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -68.75 -29.54 67.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.431 -179.119 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -78.12 -57.7 3.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.494 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -80.54 6.12 13.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.695 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.416 ' CD1' ' CD2' ' A' ' 65' ' ' LEU . 1.8 pt? -44.82 -31.56 1.27 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.062 0.458 . . . . 0.0 111.397 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 40.92 88.63 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.185 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.416 ' CD2' ' CD1' ' A' ' 63' ' ' LEU . 2.6 pp -164.27 123.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.936 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.85 24.2 2.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.43 153.27 34.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.662 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.16 -61.07 0.49 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.724 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.27 17.94 4.72 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.769 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.598 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.4 OUTLIER -150.81 -176.35 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 111.119 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.477 ' CD1' ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.72 -142.5 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.403 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.41 ' O ' ' CE2' ' A' ' 17' ' ' PHE . 0.3 OUTLIER 171.74 -178.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.23 0.538 . . . . 0.0 111.731 179.121 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.583 ' CG ' HG12 ' B' ' 85' ' ' VAL . 43.5 p90 -61.77 -58.15 9.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.639 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.466 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 43.0 tp60 -74.74 -25.38 59.07 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.608 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.493 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.95 -37.57 4.07 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.54 ' CD2' ' CE2' ' A' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.47 5.73 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.833 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.442 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 6.5 mt -53.98 -33.89 58.26 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.466 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.79 -50.05 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.242 177.874 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 5.0 mp -58.05 -57.52 12.47 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.016 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.592 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.1 OUTLIER -71.1 -46.03 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.027 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.442 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.91 -50.13 51.96 Favored Glycine 0 C--N 1.333 0.412 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.412 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.65 -35.12 37.17 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.687 178.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.6 mt -61.74 -45.99 91.57 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.965 0.412 . . . . 0.0 109.979 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.81 62.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.873 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.583 HG12 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.41 9.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.649 -179.598 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.73 13.01 17.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.341 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.77 -39.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.578 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.402 ' HB3' HD11 ' B' ' 14' ' ' ILE . 1.4 t-80 -107.39 67.15 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.697 0.284 . . . . 0.0 111.737 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.7 -168.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m 76.09 5.51 3.75 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.652 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 170.35 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.17 -27.7 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.165 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.8 ttpt -60.66 -66.64 0.5 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.889 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.17 -61.88 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.069 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.548 ' N ' ' HD3' ' A' ' 96' ' ' PRO . . . 54.52 51.16 7.4 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.657 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.576 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 38.2 Cg_exo -57.64 -49.96 11.92 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.984 1.789 . . . . 0.0 111.503 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.576 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 82.5 Cg_endo -87.51 -51.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.478 2.119 . . . . 0.0 111.703 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 40.11 92.32 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.829 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.68 115.66 30.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -93.08 -63.39 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.928 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.818 0.342 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.425 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 1.3 mtp180 -89.89 -51.61 0.34 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.976 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 25.0 Cg_exo -67.78 -131.35 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.073 2.516 . . . . 0.0 111.86 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.432 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -172.65 146.96 1.74 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.317 0.58 . . . . 0.0 111.142 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.69 -46.48 10.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.094 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.502 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.16 -41.82 97.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.894 179.048 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.432 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 1.5 mt-10 -51.65 -34.71 39.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.936 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.41 -35.38 40.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.757 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.433 ' SG ' HD22 ' A' ' 13' ' ' LEU . 3.4 p -65.62 -40.59 92.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.07 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.611 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.6 mp -69.85 -56.2 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.412 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.14 -27.43 14.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.878 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.9 mm? -59.84 -29.56 68.36 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.12 0.486 . . . . 0.0 112.085 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.77 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 8.0 mt -70.73 -38.96 74.99 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 121.478 0.656 . . . . 0.0 110.526 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.8 58.43 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.387 -1.279 . . . . 0.0 112.311 -176.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.902 HG21 ' O ' ' B' ' 13' ' ' LEU . 25.2 m -52.15 -39.05 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 177.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 9.0 t80 -77.9 -58.52 3.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.839 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.7 mm-40 -48.91 -30.84 6.36 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -51.65 68.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.702 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.457 ' HB3' HD23 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.94 -49.39 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.869 0.842 . . . . 0.0 109.995 178.459 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.55 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -57.28 -52.08 66.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.23 -1.35 . . . . 0.0 111.859 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.12 -168.31 2.66 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.6 104.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.951 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 60.83 156.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.94 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.22 155.55 31.8 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.442 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -99.75 163.12 12.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m 62.38 151.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 m -84.8 60.9 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.41 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 31.9 p -123.65 -178.36 4.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.248 0.546 . . . . 0.0 111.025 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.55 ' HG ' ' CA ' ' B' ' 21' ' ' ALA . 0.4 OUTLIER -131.63 -139.83 0.21 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.877 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.429 ' N ' HD21 ' B' ' 30' ' ' LEU . 1.3 p -164.43 136.63 4.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' B' ' 36' ' ' LEU . 3.4 pttt -49.59 -35.67 21.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.991 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.824 ' HA ' ' CD2' ' B' ' 36' ' ' LEU . 12.5 m -74.46 -53.06 10.28 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.755 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.456 ' HB3' ' CD1' ' B' ' 20' ' ' TYR . 25.4 mt-10 -55.68 -28.17 54.14 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.547 ' CE2' ' CD2' ' B' ' 76' ' ' PHE . 1.3 t80 -78.27 -42.95 29.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.183 178.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.824 ' CD2' ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -68.3 -20.98 64.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.474 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -81.03 -26.54 36.31 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.133 0.492 . . . . 0.0 109.832 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.454 ' CZ ' ' CB ' ' B' ' 42' ' ' GLU . 45.9 t80 -69.46 -24.54 63.81 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.588 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.421 ' O ' ' C ' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -72.39 -41.65 66.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.611 -179.595 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.08 -19.34 60.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.349 -179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 28.5 p -106.32 -76.68 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.454 ' CB ' ' CZ ' ' B' ' 38' ' ' PHE . 2.0 mm-40 -68.33 -33.06 73.61 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' B' ' 39' ' ' MET . 15.3 mt -122.16 43.93 2.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.134 0.492 . . . . 0.0 110.589 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.69 -25.03 58.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.88 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.05 -23.24 67.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.784 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -95.59 -27.94 15.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.934 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.7 t -125.23 42.64 3.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.918 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.13 -71.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -89.15 9.89 23.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.382 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 57.13 38.54 29.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.908 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -37.8 67.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.72 101.92 15.32 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.744 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -70.33 -0.84 7.99 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.88 2.387 . . . . 0.0 112.99 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.541 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -100.37 2.02 56.13 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.788 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 23.7 t -84.74 -61.9 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.078 0.466 . . . . 0.0 111.426 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.4 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -75.06 -51.24 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.723 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.62 -33.76 64.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.508 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -64.26 -40.3 95.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.642 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.548 ' CG ' ' N ' ' B' ' 60' ' ' MET . 0.0 OUTLIER -61.78 -54.24 45.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.176 -179.4 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.548 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -68.59 -29.62 68.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.48 -179.219 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -78.11 -57.79 3.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' B' ' 62' ' ' LYS . 9.5 mptt -80.49 6.11 13.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.738 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.41 ' CD1' ' CD2' ' B' ' 65' ' ' LEU . 1.8 pt? -44.82 -31.52 1.25 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.02 0.438 . . . . 0.0 111.407 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 6.6 t70 40.86 88.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.165 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.41 ' CD2' ' CD1' ' B' ' 63' ' ' LEU . 2.6 pp -164.25 123.13 1.89 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.99 24.25 2.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.907 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.45 153.27 34.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.17 -61.02 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.683 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 17.89 4.77 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.743 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.59 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER -150.71 -176.21 5.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.775 0.321 . . . . 0.0 111.233 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.469 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -65.86 -142.44 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.417 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.406 ' O ' ' CE2' ' B' ' 17' ' ' PHE . 0.3 OUTLIER 171.75 -178.29 0.06 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.197 0.523 . . . . 0.0 111.799 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.583 ' CG ' HG12 ' A' ' 85' ' ' VAL . 44.0 p90 -61.77 -58.22 8.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.648 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.463 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 42.9 tp60 -74.67 -25.37 59.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.623 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.509 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.87 -37.63 4.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.192 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.547 ' CD2' ' CE2' ' B' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.33 5.86 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.866 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.439 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 6.4 mt -54.15 -33.81 58.86 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.463 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.85 -50.02 14.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.233 177.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.537 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 5.0 mp -58.01 -57.65 11.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.955 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.591 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -70.94 -46.13 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.071 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.439 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.89 -50.22 51.43 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.412 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.15 36.5 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.68 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.7 mt -61.66 -45.98 91.7 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 121.032 0.444 . . . . 0.0 110.009 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.39 -31.7 62.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.007 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.583 HG12 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.38 -17.52 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.61 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.63 12.96 17.34 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.361 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.79 -39.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.625 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.409 ' HB3' HD11 ' A' ' 14' ' ' ILE . 1.4 t-80 -107.29 67.07 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.75 -168.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.363 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 7.8 m 76.1 5.4 3.75 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.622 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 170.36 -52.04 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.78 179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p -59.3 -27.66 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.126 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -60.65 -66.69 0.49 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.08 -61.94 1.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.552 ' N ' ' HD3' ' B' ' 96' ' ' PRO . . . 54.57 51.11 7.29 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.636 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.576 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 38.5 Cg_exo -57.61 -49.87 12.21 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.994 1.796 . . . . 0.0 111.588 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.576 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 80.4 Cg_endo -87.59 -51.72 0.03 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 122.567 2.178 . . . . 0.0 111.687 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 40.23 92.22 0.01 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.782 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.55 115.57 30.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.863 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -93.04 -63.49 1.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.807 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.865 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 p . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.852 0.358 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 3' ' ' PRO . 0.5 OUTLIER -169.63 -64.11 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.948 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 2' ' ' ARG . 71.7 Cg_endo -66.06 -99.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.723 2.282 . . . . 0.0 112.33 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.425 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -162.19 145.96 12.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.374 0.607 . . . . 0.0 111.059 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.81 -47.76 10.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.034 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.474 HG23 HD12 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -63.42 -39.18 93.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.218 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.6 OUTLIER -52.28 -34.28 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.39 -39.68 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.01 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.436 ' HB2' HD23 ' B' ' 13' ' ' LEU . 2.8 p -58.6 -42.47 88.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.431 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.555 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -67.5 -56.05 14.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.906 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.482 ' HA ' HD13 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.88 -27.34 12.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.538 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.507 ' O ' HG12 ' A' ' 16' ' ' VAL . 3.5 m -71.58 -55.84 7.0 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.904 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -63.55 -28.42 69.93 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.5 mt -70.64 -37.01 67.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.574 0.702 . . . . 0.0 110.645 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.47 -33.08 58.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.278 -176.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.904 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.5 m -53.19 -38.95 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 177.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.495 ' CE2' ' HB2' ' A' ' 30' ' ' LEU . 2.0 t80 -75.25 -57.7 3.73 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.535 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.755 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -48.87 -30.39 5.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -52.12 66.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.501 -0.479 . . . . 0.0 111.147 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.418 ' CE1' ' HB2' ' A' ' 38' ' ' PHE . 17.4 m-85 -81.17 -47.81 12.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 17' ' ' PHE . . . -56.98 -25.05 57.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.645 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 158.59 31.39 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.349 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.4 92.93 1.18 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.349 . . . . 0.0 110.955 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.67 -49.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.87 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.76 -50.49 0.95 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.506 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -156.53 -67.03 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 110.986 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.0 t 59.1 79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.803 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.28 -17.56 7.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.574 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.434 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 16.6 p -139.32 178.73 6.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.127 0.489 . . . . 0.0 111.148 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.495 ' HB2' ' CE2' ' A' ' 17' ' ' PHE . 1.3 tt -125.27 -115.28 0.29 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.968 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.494 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 43.2 t 176.01 129.14 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.67 -35.7 22.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.2 -44.15 54.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.44 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.7 OUTLIER -58.48 -28.84 65.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 0.0 110.1 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -70.49 -27.95 64.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.917 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.704 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.46 -58.98 5.72 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.677 0.751 . . . . 0.0 111.121 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.41 ' O ' ' CG2' ' A' ' 41' ' ' THR . 3.1 m -56.17 -44.09 79.02 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.46 -178.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.426 ' HA ' ' CG2' ' A' ' 41' ' ' THR . 10.2 t80 -57.57 -29.08 64.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.812 0.339 . . . . 0.0 110.748 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.436 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -76.52 -41.28 47.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.099 0.476 . . . . 0.0 110.759 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -73.67 -19.46 60.82 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.244 -179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.426 ' CG2' ' HA ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -98.18 -66.93 0.87 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -96.29 -20.98 18.12 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -176.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 31.3 mt -120.61 45.89 2.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.203 0.525 . . . . 0.0 110.59 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -32.08 35.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.077 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.47 -23.65 51.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.839 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.43 ' CD1' HD21 ' A' ' 43' ' ' LEU . 77.3 m-85 -90.42 -8.48 50.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.112 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.41 ' CG2' ' HG2' ' A' ' 39' ' ' MET . 6.7 p -112.84 -28.37 7.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.008 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -53.7 -79.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.926 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.406 ' O ' ' N ' ' A' ' 51' ' ' LYS . 14.1 m-20 -59.26 -55.54 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.323 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.7 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.431 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 49' ' ' ASN . 4.1 ttmt 59.69 25.57 14.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.931 0.395 . . . . 0.0 110.493 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -170.74 106.41 0.41 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.494 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.23 36.74 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.547 2.164 . . . . 0.0 112.801 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.488 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -137.29 5.03 3.51 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.95 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.66 -63.21 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.782 0.325 . . . . 0.0 111.431 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -50.37 67.98 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.89 -45.13 78.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.6 -25.33 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.891 0.377 . . . . 0.0 110.967 -179.809 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.833 ' HB3' ' HG ' ' A' ' 79' ' ' LEU . 9.5 mmm -65.62 -54.6 25.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.489 0.662 . . . . 0.0 112.006 -179.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.445 ' HA ' ' CE ' ' A' ' 60' ' ' MET . 0.0 OUTLIER -73.7 -48.69 30.17 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.722 -1.127 . . . . 0.0 112.409 -178.759 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.417 ' HG3' ' N ' ' A' ' 62' ' ' LYS . 16.9 pttt -66.78 -52.71 40.82 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.687 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' N ' ' HG3' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -81.1 6.03 14.93 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.383 179.212 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.448 HD21 ' N ' ' A' ' 63' ' ' LEU . 0.7 OUTLIER -47.28 -27.76 1.68 Allowed 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.386 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.401 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.9 OUTLIER 34.18 83.67 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.292 179.62 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.427 ' CD2' ' CD1' ' A' ' 63' ' ' LEU . 4.1 pp -134.57 152.4 51.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.89 0.376 . . . . 0.0 111.14 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -145.25 89.62 1.96 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.42 -50.07 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.724 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.77 36.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.697 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 69.84 13.78 69.58 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.679 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.434 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.0 OUTLIER -119.52 -174.46 2.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 111.15 -179.807 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.494 ' HB2' ' N ' ' A' ' 31' ' ' SER . 0.4 OUTLIER -69.56 -140.7 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.542 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.429 ' O ' ' CE2' ' A' ' 17' ' ' PHE . 0.6 OUTLIER 173.45 169.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 0.0 111.062 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.472 ' CB ' ' CG1' ' B' ' 85' ' ' VAL . 2.8 m-85 -59.13 -62.33 1.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.91 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 78' ' ' ASN . 50.0 tp60 -67.84 -28.86 67.91 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.65 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.51 -40.53 5.69 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 110.28 179.7 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' CG2' ' A' ' 16' ' ' VAL . 1.7 t80 -72.05 -53.99 11.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.277 178.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.403 HD23 ' CB ' ' A' ' 13' ' ' LEU . 5.7 mt -54.75 -33.81 61.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.4 m-20 -74.41 -49.85 20.9 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.38 178.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.897 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 7.3 mp -65.03 -58.29 6.46 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.721 -179.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.543 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -65.91 -46.68 87.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 O-C-N 123.351 0.407 . . . . 0.0 111.259 179.481 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.452 ' N ' ' CG2' ' A' ' 80' ' ' ILE . . . -55.72 -50.43 60.83 Favored Glycine 0 CA--C 1.506 -0.488 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.42 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -55.61 -29.89 54.96 Favored Glycine 0 CA--C 1.523 0.54 0 C-N-CA 120.411 -0.9 . . . . 0.0 111.663 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.897 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 24.6 mt -66.57 -47.32 73.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.075 0.464 . . . . 0.0 110.198 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.21 -34.71 64.16 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.801 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.468 ' CG1' ' CB ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.08 -17.56 9.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.31 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HA ' HG12 ' A' ' 92' ' ' VAL . . . -116.06 16.61 16.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.358 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' A' ' 83' ' ' LEU . 22.6 t -163.55 -30.85 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 57.2 t60 -84.5 51.73 2.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.817 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.64 32.6 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.401 ' OG ' ' CE2' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -94.17 -67.03 0.88 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.486 179.623 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.19 -35.96 7.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.337 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.415 HG12 ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -57.19 -33.21 42.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.878 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -15.98 64.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.932 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.411 ' C ' ' HD3' ' A' ' 96' ' ' PRO . . . -136.34 58.93 1.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.807 0.336 . . . . 0.0 111.263 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -126.98 64.99 62.28 Favored Pre-proline 0 CA--C 1.531 0.23 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.302 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.457 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 41.1 Cg_exo -58.81 -47.36 18.68 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.651 2.234 . . . . 0.0 112.918 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.457 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 98.4 Cg_endo -79.88 -3.64 12.9 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.307 2.005 . . . . 0.0 112.655 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.79 11.03 23.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.283 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 54.05 177.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.829 0.347 . . . . 0.0 110.978 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 0.404 ' HG3' ' CD2' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -107.51 -30.74 8.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.404 ' CD2' ' HG3' ' A' ' 100' ' ' ARG . 13.2 p90 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.929 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.778 0.323 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.451 ' CB ' ' CD ' ' B' ' 3' ' ' PRO . 0.5 OUTLIER -169.56 -64.1 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' B' ' 2' ' ' ARG . 70.5 Cg_endo -66.08 -99.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.758 2.306 . . . . 0.0 112.278 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -162.1 146.0 12.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 111.018 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.84 -47.73 11.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.027 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.477 HG23 HD12 ' B' ' 10' ' ' ILE . 0.9 OUTLIER -63.44 -39.13 93.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.247 179.221 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' B' ' 4' ' ' THR . 0.6 OUTLIER -52.39 -34.24 47.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.705 179.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.42 -39.58 32.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.987 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.42 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 2.8 p -58.64 -42.51 88.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.372 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.545 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -67.57 -56.05 14.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.819 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.48 ' HA ' HD13 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.9 -27.23 12.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.494 ' O ' HG12 ' B' ' 16' ' ' VAL . 3.5 m -71.75 -55.67 7.2 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.905 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -63.68 -28.36 69.84 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.767 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.5 mt -70.73 -36.96 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.562 0.696 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.54 -33.08 58.57 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.233 -176.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.905 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.7 m -53.23 -38.86 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.491 ' CE2' ' HB2' ' B' ' 30' ' ' LEU . 2.0 t80 -75.24 -57.75 3.71 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.58 179.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.767 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -48.96 -30.38 5.91 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -52.29 65.96 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.101 -178.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' B' ' 38' ' ' PHE . 17.4 m-85 -81.04 -47.89 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.767 0.794 . . . . 0.0 109.873 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' B' ' 17' ' ' PHE . . . -56.87 -25.08 55.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.632 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.86 158.57 31.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.389 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.43 92.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.349 . . . . 0.0 110.932 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.74 -49.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.793 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.78 -50.34 0.96 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.557 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -156.61 -66.98 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.812 0.339 . . . . 0.0 110.948 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t 59.06 79.14 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.33 -17.54 7.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.579 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 16.6 p -139.3 178.77 6.95 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.141 0.496 . . . . 0.0 111.166 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.491 ' HB2' ' CE2' ' B' ' 17' ' ' PHE . 1.3 tt -125.29 -115.34 0.28 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.951 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.503 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 43.4 t 176.01 129.16 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.7 -35.79 23.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.914 -179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.722 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.07 -44.2 54.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.886 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.7 OUTLIER -58.57 -28.78 65.86 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.094 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -70.38 -28.09 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.964 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.722 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.51 -58.89 6.07 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.714 0.769 . . . . 0.0 111.057 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' SER . . . . . 0.414 ' O ' ' CG2' ' B' ' 41' ' ' THR . 3.2 m -56.13 -44.18 78.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.421 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.422 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 10.2 t80 -57.47 -29.14 64.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.899 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.434 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -76.5 -41.34 47.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.692 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -73.61 -19.49 60.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.221 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.416 ' CG2' ' HA ' ' B' ' 38' ' ' PHE . 0.6 OUTLIER -98.22 -66.93 0.87 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -177.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -96.23 -20.92 18.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 -176.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.435 HD21 ' CD1' ' B' ' 46' ' ' PHE . 31.6 mt -120.57 45.78 2.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.618 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.75 -32.14 35.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.998 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.51 -23.67 51.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.754 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.435 ' CD1' HD21 ' B' ' 43' ' ' LEU . 77.2 m-85 -90.35 -8.52 50.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.18 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.403 ' CG2' ' HG2' ' B' ' 39' ' ' MET . 6.6 p -112.79 -28.4 7.78 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.024 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 mttt -53.79 -79.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.907 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.412 ' O ' ' N ' ' B' ' 51' ' ' LYS . 14.1 m-20 -59.23 -55.53 33.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.865 0.364 . . . . 0.0 110.351 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.66 -80.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.526 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' B' ' 49' ' ' ASN . 4.1 ttmt 59.74 25.51 14.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 110.49 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -170.63 106.46 0.42 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.564 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.28 36.72 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.545 2.163 . . . . 0.0 112.791 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -137.22 4.97 3.52 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.906 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -84.66 -63.2 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.946 0.373 . . . . 0.0 111.422 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -50.28 68.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.84 -45.2 78.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -58.62 -25.23 62.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.95 0.405 . . . . 0.0 111.024 -179.784 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.855 ' HB3' ' HG ' ' B' ' 79' ' ' LEU . 9.5 mmm -65.65 -54.62 25.13 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.497 0.665 . . . . 0.0 112.021 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.448 ' CE ' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER -73.73 -48.64 30.39 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.436 -178.716 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.419 ' CG ' ' N ' ' B' ' 62' ' ' LYS . 16.8 pttt -66.64 -52.82 40.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.762 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . 0.419 ' N ' ' CG ' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -81.06 5.98 14.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.446 179.188 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.431 ' CD1' ' CD2' ' B' ' 65' ' ' LEU . 0.7 OUTLIER -47.23 -27.73 1.63 Allowed 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.376 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . 0.402 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.9 OUTLIER 34.14 83.67 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.313 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.431 ' CD2' ' CD1' ' B' ' 63' ' ' LEU . 4.0 pp -134.57 152.4 51.76 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.934 0.397 . . . . 0.0 111.045 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -145.26 89.6 1.96 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.37 -49.98 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.766 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.9 36.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.68 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 69.79 13.74 69.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.631 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.419 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.0 OUTLIER -119.43 -174.42 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.933 0.397 . . . . 0.0 111.122 -179.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.503 ' HB2' ' N ' ' B' ' 31' ' ' SER . 0.4 OUTLIER -69.66 -140.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.429 ' O ' ' CE2' ' B' ' 17' ' ' PHE . 0.6 OUTLIER 173.36 169.86 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.933 0.396 . . . . 0.0 111.044 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.468 ' CB ' ' CG1' ' A' ' 85' ' ' VAL . 2.8 m-85 -59.16 -62.32 1.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.86 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.521 ' O ' ' N ' ' B' ' 78' ' ' ASN . 49.9 tp60 -67.97 -28.75 67.72 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.625 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.54 -40.52 5.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 110.201 179.688 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.462 ' CE1' ' CG2' ' B' ' 16' ' ' VAL . 1.7 t80 -72.05 -54.04 11.05 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.294 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.413 HD23 ' CB ' ' B' ' 13' ' ' LEU . 5.7 mt -54.68 -33.84 61.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.402 0.62 . . . . 0.0 109.516 178.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.521 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.4 m-20 -74.44 -49.85 20.78 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.33 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.895 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 7.2 mp -65.01 -58.31 6.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.732 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.541 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -65.97 -46.55 87.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 O-C-N 123.386 0.429 . . . . 0.0 111.283 179.524 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.456 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -55.72 -50.47 60.61 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.44 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -55.45 -30.03 54.68 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.467 -0.873 . . . . 0.0 111.69 177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.895 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 24.7 mt -66.69 -47.22 73.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.043 0.449 . . . . 0.0 110.177 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.24 -34.81 64.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.689 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.472 ' CG1' ' CB ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.03 -17.48 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.364 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . 0.411 ' HA ' HG12 ' B' ' 92' ' ' VAL . . . -116.09 16.56 16.0 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.244 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' B' ' 83' ' ' LEU . 22.8 t -163.53 -30.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 57.1 t60 -84.48 51.72 2.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.831 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.62 32.57 0.06 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' SER . . . . . 0.409 ' OG ' ' CE2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -94.09 -67.04 0.88 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 110.486 179.645 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.15 -36.05 7.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.389 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . 0.411 HG12 ' HA ' ' B' ' 86' ' ' ALA . 0.0 OUTLIER -57.04 -33.25 42.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.957 179.698 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -15.99 64.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.915 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . 0.404 ' C ' ' HD3' ' B' ' 96' ' ' PRO . . . -136.36 58.86 1.72 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.312 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -126.91 64.9 61.38 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.458 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 40.6 Cg_exo -58.65 -47.45 18.77 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.706 2.271 . . . . 0.0 112.95 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.458 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 99.0 Cg_endo -79.86 -3.67 12.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.345 2.03 . . . . 0.0 112.54 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.84 11.03 23.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.221 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp 53.99 177.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.058 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . 0.402 ' HG3' ' CD2' ' B' ' 101' ' ' PHE . 0.0 OUTLIER -107.52 -30.77 8.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . 0.402 ' CD2' ' HG3' ' B' ' 100' ' ' ARG . 12.9 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.868 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.798 0.333 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.422 ' N ' ' HD3' ' A' ' 3' ' ' PRO . 9.0 mmp_? 59.07 64.4 3.22 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.997 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 2' ' ' ARG . 34.7 Cg_exo -64.37 -126.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.022 2.482 . . . . 0.0 111.986 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.448 HG21 ' HB2' ' A' ' 7' ' ' GLU . 10.1 t -95.45 156.72 16.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.67 0.748 . . . . 0.0 111.263 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.9 -48.04 11.24 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.868 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.515 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 19.9 m -67.11 -34.42 77.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.736 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.467 ' HA ' HD13 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -51.91 -45.98 64.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.882 0.373 . . . . 0.0 110.579 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -26.81 66.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.401 178.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.431 ' HA ' ' HB3' ' B' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.678 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.581 ' O ' HG13 ' A' ' 14' ' ' ILE . 1.6 mp -48.9 -56.11 2.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.877 0.37 . . . . 0.0 111.652 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.535 ' HA ' HD11 ' A' ' 14' ' ' ILE . 5.2 mt-10 -51.85 -27.19 11.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.722 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.51 ' O ' HG11 ' A' ' 16' ' ' VAL . 3.4 m -62.09 -55.9 24.26 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.968 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -76.04 -27.83 57.46 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.763 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.2 mt -67.15 -37.3 78.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.489 0.662 . . . . 0.0 111.008 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.92 -32.59 57.48 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.565 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.968 HG22 ' O ' ' A' ' 13' ' ' LEU . 22.1 m -52.02 -38.2 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.502 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 7.6 t80 -77.4 -58.42 3.29 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.244 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.763 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.7 mm-40 -49.12 -25.61 2.25 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.3 -52.74 36.84 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.916 -178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.516 ' HB3' HD23 ' A' ' 30' ' ' LEU . 8.1 m-85 -81.6 -39.47 24.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.828 0.823 . . . . 0.0 109.894 178.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 17' ' ' PHE . . . -70.6 -27.82 64.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.853 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -125.66 123.58 4.95 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.567 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.73 29.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.749 0.309 . . . . 0.0 110.848 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -166.16 31.75 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.917 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.89 -61.17 1.66 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.501 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -79.2 154.59 29.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 82.2 p -162.31 115.26 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.798 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.2 p -134.43 -41.76 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.48 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 2.5 p -134.93 154.76 51.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.681 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -111.05 -136.39 0.37 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.918 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -168.01 133.84 1.94 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.771 0.32 . . . . 0.0 110.539 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.86 -39.97 40.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.728 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -69.17 -46.63 67.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.435 ' HB3' HD22 ' A' ' 30' ' ' LEU . 3.1 mt-10 -57.76 -29.74 65.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.033 0.444 . . . . 0.0 110.287 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.505 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -69.31 -29.4 67.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.111 179.012 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.728 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -51.73 -59.06 4.73 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.636 0.731 . . . . 0.0 111.297 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -47.23 81.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.57 -1.195 . . . . 0.0 111.386 -178.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.436 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 10.8 t80 -57.73 -51.07 71.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.673 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.551 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -73.53 -19.84 60.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.881 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -118.97 -80.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.107 0.479 . . . . 0.0 111.501 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.434 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 2.2 mm-40 -46.0 -38.58 7.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.027 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.425 HD22 ' CD1' ' A' ' 46' ' ' PHE . 23.3 mt -130.69 50.8 2.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.937 0.399 . . . . 0.0 110.679 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.78 -35.19 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.099 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.98 -25.06 57.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.162 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.454 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 43.6 m-85 -91.97 15.09 13.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.3 p -139.12 -42.65 0.46 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.492 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.91 94.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.973 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 58.75 85.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.66 134.82 53.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.851 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -27.03 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.23 103.96 26.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -81.2 5.42 6.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.621 2.214 . . . . 0.0 112.874 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.74 -11.97 29.31 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.85 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -52.92 -59.86 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.766 0.317 . . . . 0.0 111.404 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.445 ' O ' ' HG2' ' A' ' 59' ' ' MET . 0.2 OUTLIER -67.81 -51.68 45.85 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.152 0.501 . . . . 0.0 110.488 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.409 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 1.7 t0 -55.11 -26.83 40.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.905 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.97 -47.26 85.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.682 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.791 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 5.1 ptp -69.31 -53.78 17.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.573 ' N ' ' HG3' ' A' ' 59' ' ' MET . 2.0 mtm -59.96 -26.27 65.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.898 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -61.11 -59.88 4.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.647 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -6.05 57.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.732 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.462 ' HB3' ' O ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -81.26 6.01 15.4 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.627 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.08 84.89 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.849 0.357 . . . . 0.0 110.748 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' N ' ' O ' ' A' ' 63' ' ' LEU . 2.2 mm? -73.72 116.61 14.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.896 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.45 -43.0 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.775 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.93 161.15 13.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.981 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 76.3 -53.35 0.6 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.686 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.83 23.43 23.14 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.204 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.544 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.1 mm-40 -155.95 167.79 29.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.699 0.285 . . . . 0.0 111.401 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.681 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -64.49 -132.79 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.663 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.485 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 2.3 t0 176.71 -171.37 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.81 0.732 . . . . 0.0 111.444 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.584 ' HB2' HG13 ' B' ' 85' ' ' VAL . 44.4 p90 -77.6 -54.87 5.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.489 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.478 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -77.63 -30.36 52.19 Favored 'General case' 0 CA--C 1.515 -0.37 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.326 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.83 -33.1 1.8 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.52 ' CE1' HG21 ' A' ' 16' ' ' VAL . 2.0 t80 -80.44 -54.4 5.73 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.847 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.427 HD21 HD21 ' B' ' 77' ' ' LEU . 6.9 mt -55.98 -33.37 64.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.14 -39.68 54.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.135 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.791 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.7 mp -64.56 -57.77 8.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.748 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.572 HG21 ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.82 -43.71 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.139 179.427 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.71 -50.31 49.93 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.005 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -51.71 -35.52 38.57 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.359 -0.924 . . . . 0.0 111.427 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.554 ' CD2' ' HE1' ' A' ' 59' ' ' MET . 8.4 mt -62.19 -46.07 90.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.921 0.391 . . . . 0.0 110.098 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.32 -35.42 65.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 110.849 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.578 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -81.09 -17.15 12.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.115 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -117.35 15.72 14.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.552 -179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -160.99 -27.43 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -179.443 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.508 ' HB2' ' O ' ' A' ' 84' ' ' ALA . 14.2 m-70 -93.79 27.56 2.68 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.611 -0.436 . . . . 0.0 112.159 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 59.34 16.51 5.11 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.402 ' CB ' ' HA ' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -72.94 -50.7 21.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.949 0.404 . . . . 0.0 109.95 179.334 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.434 ' HB2' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -113.03 -38.75 4.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.779 178.775 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 1.6 m -58.59 -25.45 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.087 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -81.36 -2.39 49.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.365 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.73 64.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.78 0.324 . . . . 0.0 111.175 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.464 ' N ' ' HD3' ' A' ' 96' ' ' PRO . . . -141.64 60.07 10.92 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.314 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 35.0 Cg_exo -59.41 -46.64 20.17 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.68 2.253 . . . . 0.0 112.985 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 86.4 Cg_endo -82.62 -17.78 7.16 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.511 2.14 . . . . 0.0 112.918 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -50.14 109.59 0.31 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.904 0.383 . . . . 0.0 111.128 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -59.81 -176.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.43 75.0 1.38 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.955 -179.993 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.766 0.317 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.414 ' N ' ' HD3' ' B' ' 3' ' ' PRO . 9.1 mmp_? 59.05 64.37 3.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.994 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.425 ' HB2' ' CB ' ' B' ' 7' ' ' GLU . 35.1 Cg_exo -64.35 -126.85 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.024 2.483 . . . . 0.0 112.076 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.45 HG21 ' HB2' ' B' ' 7' ' ' GLU . 10.1 t -95.55 156.75 16.19 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.625 0.726 . . . . 0.0 111.328 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.88 -48.14 11.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.801 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.509 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 19.8 m -67.06 -34.33 77.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.762 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.48 ' HA ' HD13 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -51.99 -45.95 64.68 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.534 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -26.8 66.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.09 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.655 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.582 ' O ' HG13 ' B' ' 14' ' ' ILE . 1.6 mp -48.94 -56.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.543 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.551 ' HA ' HD11 ' B' ' 14' ' ' ILE . 5.3 mt-10 -51.77 -27.27 11.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.7 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.5 ' O ' HG11 ' B' ' 16' ' ' VAL . 3.3 m -62.07 -55.83 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.968 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -76.17 -27.75 57.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.752 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.1 mt -67.19 -37.27 78.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 O-C-N 121.558 -0.714 . . . . 0.0 110.964 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.99 -32.63 57.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.469 -1.241 . . . . 0.0 112.539 -176.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.968 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.0 m -52.05 -38.17 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.51 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 7.5 t80 -77.46 -58.38 3.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.155 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.752 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.7 mm-40 -49.17 -25.65 2.33 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.13 -52.83 36.83 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.891 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.519 ' HB3' HD23 ' B' ' 30' ' ' LEU . 8.1 m-85 -81.63 -39.44 24.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.808 0.813 . . . . 0.0 109.864 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' B' ' 17' ' ' PHE . . . -70.64 -27.83 64.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.816 -179.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -125.61 123.51 4.93 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.629 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.68 29.19 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.862 0.363 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -166.12 31.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.8 -61.07 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.537 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -79.2 154.53 29.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.908 0.385 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 81.0 p -162.25 115.19 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.812 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 12.0 p -134.52 -41.7 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.472 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.555 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 2.4 p -135.05 154.85 51.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.535 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.683 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.2 OUTLIER -111.02 -136.37 0.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.015 179.817 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -167.98 133.82 1.95 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.756 0.312 . . . . 0.0 110.577 179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -39.97 40.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.96 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.728 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -69.2 -46.65 66.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.58 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.459 ' HB3' HD22 ' B' ' 30' ' ' LEU . 3.1 mt-10 -57.76 -29.76 65.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.953 0.406 . . . . 0.0 110.195 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.503 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -69.25 -29.51 67.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.069 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.728 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.61 -59.02 4.74 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.664 0.745 . . . . 0.0 111.371 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.42 -47.16 82.49 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.346 -178.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.44 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 10.9 t80 -57.76 -51.07 71.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.65 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -30.93 71.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.547 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -73.48 -19.8 60.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.843 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -119.02 -80.38 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 0.0 111.491 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.434 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.1 mm-40 -46.03 -38.56 8.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.031 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.435 HD22 ' CD1' ' B' ' 46' ' ' PHE . 23.4 mt -130.77 50.81 2.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.982 0.42 . . . . 0.0 110.662 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.77 -35.21 33.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.068 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.05 -24.99 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.175 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 43.9 m-85 -91.87 14.96 14.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.133 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 26.3 p -139.01 -42.77 0.47 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.95 0.405 . . . . 0.0 110.445 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.8 94.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.032 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.73 85.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.85 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.67 134.85 53.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.931 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -27.03 63.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -100.24 103.96 26.54 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.896 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.19 5.46 6.23 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.547 2.164 . . . . 0.0 112.904 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.76 -11.88 29.47 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.909 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 41.0 t -52.97 -59.89 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.741 0.305 . . . . 0.0 111.314 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.441 ' O ' ' HG2' ' B' ' 59' ' ' MET . 0.2 OUTLIER -67.77 -51.71 45.72 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.216 0.532 . . . . 0.0 110.536 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.409 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 1.7 t0 -55.09 -26.87 40.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.881 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -47.19 86.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.799 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 5.1 ptp -69.44 -53.81 17.48 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.908 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.572 ' N ' ' HG3' ' B' ' 59' ' ' MET . 2.0 mtm -59.95 -26.3 65.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.776 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -61.1 -59.95 4.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.618 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.25 -5.94 57.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -81.34 6.01 15.63 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.15 84.94 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.926 0.393 . . . . 0.0 110.742 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' B' ' 63' ' ' LEU . 2.2 mm? -73.67 116.62 14.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.47 -42.88 3.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.821 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 161.23 13.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.907 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 76.2 -53.32 0.61 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.684 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.85 23.5 22.89 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.144 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.555 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.1 mm-40 -156.03 167.77 29.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.762 0.315 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.683 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -64.48 -132.81 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.46 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 2.3 t0 176.67 -171.37 0.08 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.798 0.727 . . . . 0.0 111.409 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.578 ' HB2' HG13 ' A' ' 85' ' ' VAL . 44.4 p90 -77.65 -54.96 5.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.433 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -77.57 -30.38 52.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.319 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.79 -33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.858 0.361 . . . . 0.0 110.155 179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.527 ' CE1' HG21 ' B' ' 16' ' ' VAL . 2.0 t80 -80.32 -54.42 5.74 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.882 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.433 ' O ' ' N ' ' B' ' 81' ' ' GLY . 6.9 mt -55.95 -33.37 64.7 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.421 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.12 -39.8 54.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.101 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.799 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.7 mp -64.36 -57.92 7.97 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.773 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.574 HG21 ' CD1' ' B' ' 13' ' ' LEU . 0.0 OUTLIER -72.75 -43.77 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.137 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.69 -50.27 49.97 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.316 -0.945 . . . . 0.0 111.068 179.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -51.8 -35.45 39.06 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.394 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.555 ' CD2' ' HE1' ' B' ' 59' ' ' MET . 8.6 mt -62.29 -46.06 90.48 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.896 0.379 . . . . 0.0 110.048 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.504 ' O ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.42 -35.3 65.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.329 0.585 . . . . 0.0 110.812 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.584 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -81.08 -17.25 12.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.159 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -117.31 15.72 14.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.534 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.411 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.3 OUTLIER -160.98 -27.37 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' O ' ' B' ' 84' ' ' ALA . 14.1 m-70 -93.92 27.67 2.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.547 -0.461 . . . . 0.0 112.121 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 59.31 16.52 5.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' SER . . . . . 0.406 ' CB ' ' HA ' ' B' ' 85' ' ' VAL . 0.2 OUTLIER -72.88 -50.75 21.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.971 0.415 . . . . 0.0 109.931 179.359 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . 0.44 ' HB2' HG11 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -113.06 -38.69 4.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.789 178.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 1.6 m -58.61 -25.46 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.156 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -81.33 -2.44 49.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.348 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.73 64.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.801 0.334 . . . . 0.0 111.199 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.47 ' N ' ' HD3' ' B' ' 96' ' ' PRO . . . -141.67 60.12 10.96 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.282 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.47 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 35.3 Cg_exo -59.5 -46.69 19.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.623 2.215 . . . . 0.0 112.904 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 86.8 Cg_endo -82.54 -17.77 7.26 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.478 2.119 . . . . 0.0 112.99 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -50.09 109.56 0.31 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.865 0.364 . . . . 0.0 111.131 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -59.71 -176.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.02 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.53 75.07 1.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.851 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.862 179.958 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.856 0.36 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.4 OUTLIER -179.48 -51.4 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.058 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.417 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 17.2 Cg_exo -71.88 -134.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.15 2.567 . . . . 0.0 111.85 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.58 152.98 21.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 0.0 111.189 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.82 -49.06 10.97 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.421 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.481 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.25 -41.56 96.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.093 0.473 . . . . 0.0 110.194 179.207 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.484 ' HA ' HD11 ' A' ' 10' ' ' ILE . 1.0 OUTLIER -51.44 -31.61 23.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -28.31 41.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.928 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.462 ' HB2' ' CB ' ' B' ' 12' ' ' SER . 4.3 p -73.95 -40.66 62.89 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.391 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.578 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.5 mp -66.92 -56.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.902 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.506 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -52.18 -27.33 14.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.428 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.49 ' O ' HG12 ' A' ' 16' ' ' VAL . 5.9 m -72.19 -56.03 6.24 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -178.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.818 ' O ' HG21 ' A' ' 16' ' ' VAL . 3.7 mm? -64.9 -27.5 68.9 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.626 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 12.8 mt -69.06 -37.35 76.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 CA-C-O 121.491 0.662 . . . . 0.0 110.611 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.577 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -76.49 -39.69 52.41 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 114.027 -1.442 . . . . 0.0 112.402 -176.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.818 HG21 ' O ' ' A' ' 13' ' ' LEU . 20.2 m -50.96 -33.89 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.649 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 1.3 t80 -80.55 -59.01 2.85 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.222 -1.354 . . . . 0.0 113.249 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.668 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.67 -24.73 62.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -177.4 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -51.61 62.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.817 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.554 ' HB3' ' CE2' ' A' ' 38' ' ' PHE . 7.1 m-85 -80.83 -40.89 24.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.889 0.852 . . . . 0.0 109.564 177.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.668 ' HB2' ' HA ' ' A' ' 18' ' ' GLN . . . -62.58 -12.97 26.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.285 -179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -70.2 65.36 0.73 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.463 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -81.8 -51.81 7.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.92 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.73 174.65 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.86 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.69 -27.51 56.78 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.522 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -101.37 32.56 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 110.936 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -148.08 140.11 24.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.883 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.0 p -140.06 63.86 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.106 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.3 p -148.23 -179.38 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.674 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -138.97 -161.12 1.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.953 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.413 ' CB ' ' HB2' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -136.66 132.37 34.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.691 0.281 . . . . 0.0 110.398 178.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -40.64 41.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.512 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.7 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.17 -41.45 61.46 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.534 179.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 2.0 mt-10 -58.91 -32.36 69.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.079 0.466 . . . . 0.0 109.782 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.553 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -69.09 -26.88 65.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.385 179.295 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.61 -59.2 5.18 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.613 0.721 . . . . 0.0 111.191 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -60.16 -45.14 94.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.204 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.554 ' CE2' ' HB3' ' A' ' 20' ' ' TYR . 2.6 m-30 -57.8 -26.71 62.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.432 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 2.7 ttm -78.24 -56.12 4.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.89 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -57.55 -19.69 27.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.025 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.454 ' CG2' ' HG2' ' A' ' 42' ' ' GLU . 10.8 t -96.68 -30.76 13.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.454 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.5 OUTLIER -127.46 -37.5 2.0 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -177.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 7.9 mt -106.85 35.25 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.24 0.543 . . . . 0.0 110.256 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -77.11 -28.61 54.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.745 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.426 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . . . -54.15 -27.46 33.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.74 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CZ ' ' CD2' ' A' ' 88' ' ' HIS . 3.5 m-85 -86.46 -28.23 23.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.591 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 29.7 p -83.74 -33.36 25.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.212 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.426 ' HG2' ' HA ' ' A' ' 45' ' ' ALA . 1.6 pttt -72.91 -31.82 64.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.858 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -115.87 44.53 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.577 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -60.44 -61.2 2.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.271 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 59.54 25.59 14.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.42 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -174.6 118.65 0.34 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.565 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -75.13 12.4 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.68 2.254 . . . . 0.0 113.062 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.23 7.55 23.05 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.845 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 53.3 t -84.08 -62.74 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.056 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 59' ' ' MET . 6.6 tt -66.82 -51.96 49.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.664 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -26.85 47.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.036 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.9 -52.95 63.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.915 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.737 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 1.9 ptp -55.49 -53.54 55.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.915 0.388 . . . . 0.0 111.002 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.514 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -54.71 -37.93 66.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.518 -179.343 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -78.03 -31.07 50.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.867 0.365 . . . . 0.0 110.622 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.33 -23.11 40.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.991 -179.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.622 ' O ' ' N ' ' A' ' 65' ' ' LEU . 2.2 pp -81.37 7.14 12.36 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -59.6 68.34 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.018 0.437 . . . . 0.0 110.018 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.622 ' N ' ' O ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -76.21 159.84 30.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.163 -179.144 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 -94.64 20.74 8.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.82 -31.75 15.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 0.0 110.639 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 49.89 28.01 2.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.94 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -123.43 -60.67 0.19 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.738 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.518 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 1.7 mm-40 -151.34 -177.7 6.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.753 0.311 . . . . 0.0 111.423 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.674 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -64.6 -133.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.509 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.7 t0 175.46 -169.51 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 118.801 0.728 . . . . 0.0 111.49 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.524 ' CG ' HG13 ' B' ' 85' ' ' VAL . 38.4 p90 -73.69 -58.86 3.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.469 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.482 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -80.05 -25.49 40.11 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.175 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HB3' ' CD1' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -44.88 -32.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.562 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 t80 -80.12 -54.07 6.11 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.572 178.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 7.1 mt -56.97 -33.52 67.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.979 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -75.09 -42.01 57.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.275 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.737 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.2 mp -65.92 -57.3 8.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.132 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.526 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.13 -44.5 64.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.948 179.316 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.444 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.73 -50.24 50.36 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.145 -1.026 . . . . 0.0 110.731 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.451 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.63 -40.1 47.28 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.362 -0.923 . . . . 0.0 111.551 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.572 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 6.9 mt -59.17 -46.36 88.6 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.892 0.377 . . . . 0.0 110.353 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.5 -33.65 63.92 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 111.291 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.522 HG13 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -82.65 -17.07 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.282 -179.476 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.78 11.86 14.65 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.878 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 18.6 t -152.75 -39.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.0 OUTLIER -89.82 -85.27 0.21 Allowed 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.82 -179.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.417 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -133.15 177.19 7.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.734 0.302 . . . . 0.0 111.079 -179.395 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 70.7 m 60.9 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.631 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 76.25 -49.45 0.59 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.247 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 35.9 t -43.42 -53.6 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 121.078 0.466 . . . . 0.0 111.575 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.33 26.36 2.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.097 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -158.85 27.52 0.22 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.052 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.494 ' CB ' ' CD ' ' A' ' 96' ' ' PRO . . . -90.42 -68.97 0.1 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.388 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.598 ' HG2' ' HD3' ' A' ' 97' ' ' PRO . 5.8 Cg_endo -46.98 -35.84 19.27 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.762 2.308 . . . . 0.0 113.868 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.598 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 5.5 Cg_exo -74.91 -27.59 10.07 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.091 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.66 -51.52 69.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.936 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.43 128.43 44.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -77.13 124.33 27.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.926 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.747 0.308 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.417 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 0.4 OUTLIER -179.45 -51.46 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.417 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 17.2 Cg_exo -71.78 -134.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.451 0 C-N-CA 123.192 2.595 . . . . 0.0 111.924 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.55 153.05 21.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.572 0.701 . . . . 0.0 111.194 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.85 -49.06 11.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.415 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.48 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.22 -41.67 96.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 110.128 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.486 ' HA ' HD11 ' B' ' 10' ' ' ILE . 1.0 OUTLIER -51.47 -31.44 23.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.695 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -28.31 40.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.455 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 4.3 p -73.95 -40.64 62.91 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.421 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.577 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.5 mp -66.77 -56.31 14.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.895 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.51 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.4 OUTLIER -52.13 -27.34 13.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.512 ' O ' HG12 ' B' ' 16' ' ' VAL . 5.9 m -72.12 -56.11 6.15 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.813 ' O ' HG21 ' B' ' 16' ' ' VAL . 3.8 mm? -64.75 -27.69 69.07 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.612 ' O ' ' HG3' ' B' ' 18' ' ' GLN . 13.0 mt -68.99 -37.42 77.2 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.78 0 CA-C-O 121.539 0.685 . . . . 0.0 110.608 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . 0.583 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -76.42 -39.66 52.92 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 113.962 -1.472 . . . . 0.0 112.442 -176.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.813 HG21 ' O ' ' B' ' 13' ' ' LEU . 20.2 m -50.91 -33.97 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 1.3 t80 -80.5 -59.06 2.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 114.207 -1.36 . . . . 0.0 113.211 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.662 ' HA ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.7 -24.73 62.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.38 -51.61 61.97 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.88 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.546 ' HB3' ' CE2' ' B' ' 38' ' ' PHE . 7.1 m-85 -80.78 -40.95 24.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.842 0.829 . . . . 0.0 109.564 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.662 ' HB2' ' HA ' ' B' ' 18' ' ' GLN . . . -62.58 -12.94 25.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.158 -1.383 . . . . 0.0 112.327 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -70.2 65.3 0.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.495 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -81.67 -51.87 7.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.885 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.75 174.55 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.62 -27.61 56.73 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.474 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -101.35 32.51 3.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.35 . . . . 0.0 110.9 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -148.01 140.16 24.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.834 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p -140.13 63.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.127 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.53 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 9.5 p -148.18 -179.42 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.906 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.671 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -138.95 -161.07 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.019 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.417 ' CB ' ' HB2' ' B' ' 34' ' ' GLU . 0.0 OUTLIER -136.68 132.32 34.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.783 0.325 . . . . 0.0 110.359 178.809 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.65 -40.71 40.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.951 0.405 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.702 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.06 -41.53 61.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.538 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' B' ' 38' ' ' PHE . 2.0 mt-10 -58.96 -32.36 69.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 109.786 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.554 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -69.07 -26.81 65.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.446 179.237 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.6 -59.26 5.09 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -60.04 -45.19 93.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.206 -178.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.546 ' CE2' ' HB3' ' B' ' 20' ' ' TYR . 2.5 m-30 -57.8 -26.75 62.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.973 0.416 . . . . 0.0 110.729 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.436 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 2.7 ttm -78.22 -56.15 4.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.916 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -57.58 -19.61 26.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.071 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.45 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 10.7 t -96.73 -30.81 13.0 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.45 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.5 OUTLIER -127.38 -37.46 2.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.587 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 7.9 mt -106.93 35.41 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.268 0.556 . . . . 0.0 110.234 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -77.18 -28.6 54.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.777 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . 0.43 ' HA ' ' HG2' ' B' ' 48' ' ' LYS . . . -54.11 -27.5 33.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.76 179.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.423 ' CZ ' ' CD2' ' B' ' 88' ' ' HIS . 3.5 m-85 -86.41 -28.31 23.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.659 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 29.7 p -83.77 -33.35 25.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.142 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' B' ' 45' ' ' ALA . 1.5 pttt -73.02 -31.71 64.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -115.91 44.51 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 0.0 110.575 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -60.39 -61.13 2.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.284 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 59.35 25.76 14.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.483 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.442 ' HA ' ' HD3' ' B' ' 53' ' ' PRO . 0.1 OUTLIER -174.61 118.65 0.34 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.606 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' B' ' 52' ' ' ASP . 3.0 Cg_exo -75.08 12.26 1.28 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.757 2.304 . . . . 0.0 113.076 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.16 7.61 23.17 Favored Glycine 0 C--N 1.333 0.374 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.938 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 53.7 t -84.09 -62.81 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 0.0 111.039 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' B' ' 59' ' ' MET . 6.6 tt -66.72 -51.98 49.74 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.662 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -26.82 47.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.069 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.83 -52.94 63.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.978 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.739 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 1.9 ptp -55.49 -53.52 55.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.027 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.514 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -54.77 -37.81 66.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.567 -179.373 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -78.12 -30.92 49.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.96 0.409 . . . . 0.0 110.67 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -22.98 40.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.978 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.626 ' O ' ' N ' ' B' ' 65' ' ' LEU . 2.2 pp -81.42 7.23 12.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -59.55 68.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.001 0.429 . . . . 0.0 110.044 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.626 ' N ' ' O ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER -76.21 159.85 30.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.094 -179.069 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 -94.63 20.83 8.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.42 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.89 -31.77 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.648 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 49.74 28.15 2.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -123.52 -60.68 0.19 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.652 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.53 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 1.7 mm-40 -151.39 -177.81 6.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.683 0.278 . . . . 0.0 111.407 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.671 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -64.46 -133.62 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.491 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 1.7 t0 175.43 -169.55 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 118.805 0.73 . . . . 0.0 111.458 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.522 ' CG ' HG13 ' A' ' 85' ' ' VAL . 38.6 p90 -73.61 -58.88 3.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.509 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -80.06 -25.5 40.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.104 179.408 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.412 ' HB3' ' CD1' ' B' ' 71' ' ' LEU . 0.2 OUTLIER -44.93 -32.63 1.68 Allowed 'General case' 0 CA--C 1.522 -0.115 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.438 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.554 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.1 t80 -80.2 -54.01 6.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.555 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.434 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 7.1 mt -56.97 -33.63 67.27 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.902 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.457 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -74.95 -42.07 58.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.257 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.739 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.2 mp -65.95 -57.2 8.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.129 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.523 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.21 -44.57 64.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.923 179.353 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.434 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.6 -50.3 49.29 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.17 -1.014 . . . . 0.0 110.761 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.45 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.63 -40.07 47.23 Favored Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.231 -0.985 . . . . 0.0 111.618 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.566 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 7.0 mt -59.16 -46.39 88.5 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.828 0.347 . . . . 0.0 110.264 178.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.479 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.44 -33.76 63.89 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.23 0.538 . . . . 0.0 111.209 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.524 HG13 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -82.64 -17.1 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.235 -179.351 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.85 11.97 14.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.863 -179.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 18.7 t -152.78 -39.46 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.103 -179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.479 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.0 OUTLIER -89.8 -85.24 0.21 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.856 -179.196 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . 0.42 ' O ' ' HA ' ' B' ' 85' ' ' VAL . 0.1 OUTLIER -133.04 177.22 7.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.749 0.309 . . . . 0.0 111.079 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 70.5 m 60.87 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.655 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 76.19 -49.48 0.59 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.226 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 36.0 t -43.38 -53.54 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.32 26.27 3.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.171 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -158.84 27.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.086 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.489 ' CB ' ' CD ' ' B' ' 96' ' ' PRO . . . -90.46 -68.89 0.1 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.421 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.601 ' HG2' ' HD3' ' B' ' 97' ' ' PRO . 5.8 Cg_endo -46.96 -35.9 19.35 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.785 2.323 . . . . 0.0 113.766 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.601 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 5.6 Cg_exo -74.93 -27.61 10.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.27 1.98 . . . . 0.0 111.985 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.67 -51.54 69.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.992 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.36 128.44 44.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.96 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -77.07 124.37 27.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.919 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.8 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.744 0.307 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.418 ' CB ' ' HG3' ' A' ' 7' ' ' GLU . 1.1 mpt_? 58.13 105.35 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.955 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -80.89 16.79 1.54 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.256 2.637 . . . . 0.0 114.244 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.504 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -54.42 144.28 21.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.566 . . . . 0.0 111.03 -179.35 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.43 -44.24 8.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.321 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.509 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 19.3 m -71.63 -38.18 70.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.363 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.598 ' HA ' HD12 ' A' ' 10' ' ' ILE . 0.7 OUTLIER -52.49 -53.33 47.17 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.969 0.414 . . . . 0.0 110.445 179.772 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.08 -26.65 62.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.584 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 6' ' ' THR . 74.2 m -74.67 -54.42 7.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.569 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.598 HD12 ' HA ' ' A' ' 7' ' ' GLU . 2.2 mp -54.7 -56.5 10.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.847 0.356 . . . . 0.0 111.574 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.496 ' HA ' HD12 ' A' ' 14' ' ' ILE . 1.8 mt-10 -52.32 -27.46 15.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.847 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.54 ' O ' HG12 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -62.88 -55.72 23.59 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.196 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.946 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.1 mm? -74.79 -27.83 60.47 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.728 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 6.6 mt -67.2 -35.93 75.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 O-C-N 121.648 -0.657 . . . . 0.0 110.925 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.94 -32.7 45.6 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.455 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.946 HG21 ' O ' ' A' ' 13' ' ' LEU . 23.2 m -52.67 -35.83 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 176.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.591 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.1 t80 -78.02 -59.01 2.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.032 -1.44 . . . . 0.0 110.634 179.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.728 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 3.8 mm-40 -49.61 -45.69 48.38 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -47.91 -51.58 22.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.646 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.447 ' CZ ' ' HB2' ' A' ' 38' ' ' PHE . 3.4 m-85 -81.17 -31.89 33.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.672 0.749 . . . . 0.0 110.289 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.591 ' HB1' ' O ' ' A' ' 17' ' ' PHE . . . -86.72 20.13 2.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.0 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -158.11 107.02 0.3 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.303 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.73 -49.99 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 111.031 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -160.92 153.12 20.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.93 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.79 -92.19 0.53 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.577 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -109.55 169.4 8.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 110.995 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -161.43 57.02 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.759 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m -116.3 -24.17 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.641 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -140.69 153.13 45.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.137 0.494 . . . . 0.0 111.536 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.566 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.0 OUTLIER -105.96 -154.17 0.51 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.956 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 t -145.25 138.05 26.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.758 0.314 . . . . 0.0 110.455 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.476 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.81 -35.85 24.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.813 -179.719 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.69 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.35 -42.85 58.68 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.441 179.484 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -55.92 -29.03 59.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 110.035 179.676 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.56 ' CD2' HD22 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -72.21 -32.56 66.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.057 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.69 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -50.02 -59.13 4.19 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.654 0.74 . . . . 0.0 110.913 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.79 -44.27 93.87 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.7 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.447 ' HB2' ' CZ ' ' A' ' 20' ' ' TYR . 32.0 t80 -58.01 -29.64 65.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.432 ' CE ' ' CD1' ' A' ' 83' ' ' LEU . 1.1 ttm -78.08 -46.61 20.34 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.47 -19.74 63.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.028 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 t -94.35 -35.44 12.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.78 20.23 6.03 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 13.7 mt -161.84 44.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.349 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.52 -23.93 56.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.87 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.68 -14.13 62.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.229 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.45 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.2 m-85 -110.97 11.08 22.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.355 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.0 p -141.51 -34.98 0.47 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -40.95 -79.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.742 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -18.09 55.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.207 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 67.78 23.76 8.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.951 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -61.15 141.16 57.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.508 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.629 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . 10.0 t0 64.27 103.46 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -86.77 22.74 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.745 2.296 . . . . 0.0 113.129 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -127.62 -0.56 6.68 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.054 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.629 ' CG1' ' HB3' ' A' ' 52' ' ' ASP . 1.6 m -84.56 -51.05 14.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.179 0.514 . . . . 0.0 110.844 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.469 ' N ' ' CG2' ' A' ' 55' ' ' VAL . 0.1 OUTLIER -75.02 -52.01 12.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.908 -179.457 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -56.45 -29.28 61.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.264 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -52.2 66.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.252 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.738 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 2.9 ptp -54.95 -52.85 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.927 0.394 . . . . 0.0 111.175 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.5 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -62.77 -27.79 69.53 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.286 -179.424 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -40.21 39.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 0.0 110.391 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -80.13 -22.76 41.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.179 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.523 ' CD2' HD13 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -58.27 -46.08 86.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 121.108 0.48 . . . . 0.0 110.662 179.794 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 t70 65.07 49.38 2.05 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.44 HD23 ' HB3' ' A' ' 63' ' ' LEU . 2.3 mm? -51.75 94.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.018 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -174.93 -56.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 p -70.27 136.3 49.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.004 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 77.1 -50.38 0.55 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.89 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.62 21.14 20.04 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.043 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.534 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 -159.83 166.82 29.55 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.878 0.371 . . . . 0.0 111.376 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.566 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -66.41 -139.02 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.255 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.511 ' C ' ' OE1' ' A' ' 75' ' ' GLU . 4.4 p-10 172.48 -157.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.347 0.521 . . . . 0.0 111.777 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.565 ' CG ' HG13 ' B' ' 85' ' ' VAL . 29.7 p90 -84.46 -59.93 2.23 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.524 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.9 tp60 -76.98 -35.13 57.42 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -177.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.611 ' OE1' ' N ' ' A' ' 75' ' ' GLU . 0.8 OUTLIER -49.22 -26.53 2.98 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.005 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.553 ' CG ' ' HB2' ' A' ' 17' ' ' PHE . 1.1 t80 -77.33 -54.05 6.94 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.506 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 8.0 mt -57.79 -33.56 68.69 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.401 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.3 OUTLIER -76.68 -43.35 38.15 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.681 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.738 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 2.7 mp -58.08 -57.57 12.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.782 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.552 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.93 -44.17 28.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.061 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.506 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.17 51.33 Favored Glycine 0 CA--C 1.508 -0.363 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.732 179.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 85' ' ' VAL . . . -51.29 -41.13 46.89 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.147 -1.025 . . . . 0.0 111.394 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.548 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 6.6 mt -57.91 -46.8 84.42 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.623 -0.339 . . . . 0.0 110.466 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.57 -31.95 62.62 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.051 0.453 . . . . 0.0 111.058 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.565 HG13 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.17 -17.6 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.512 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.03 14.16 18.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.134 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.45 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -156.19 -37.72 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.347 179.636 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.1 t60 -91.11 157.99 16.91 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.891 0.377 . . . . 0.0 111.081 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 93.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.052 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.3 m -150.29 -67.8 0.2 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.601 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -121.05 -32.54 3.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.01 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -25.9 6.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.471 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.58 50.93 1.79 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.842 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -154.98 -46.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -135.3 65.03 62.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.161 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.446 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 48.5 Cg_exo -57.62 -46.89 24.09 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.74 2.294 . . . . 0.0 112.608 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.446 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 87.9 Cg_endo -81.1 -39.35 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.392 2.061 . . . . 0.0 112.266 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.51 147.45 48.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.879 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.64 104.2 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.05 99.5 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.855 -179.935 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.788 0.328 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.425 ' CB ' ' HG3' ' B' ' 7' ' ' GLU . 1.1 mpt_? 58.15 105.37 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.93 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -80.85 16.72 1.55 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.22 2.613 . . . . 0.0 114.267 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.502 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -54.43 144.34 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.36 0.6 . . . . 0.0 110.964 -179.271 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.45 -44.22 8.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.376 -179.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.505 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 19.6 m -71.75 -38.03 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.35 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.606 ' HA ' HD12 ' B' ' 10' ' ' ILE . 0.7 OUTLIER -52.45 -53.36 46.52 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.915 0.388 . . . . 0.0 110.461 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.12 -26.66 62.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.574 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' B' ' 6' ' ' THR . 74.2 m -74.59 -54.41 7.52 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.604 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.606 HD12 ' HA ' ' B' ' 7' ' ' GLU . 2.2 mp -54.72 -56.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 111.615 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.489 ' HA ' HD12 ' B' ' 14' ' ' ILE . 1.8 mt-10 -52.38 -27.34 15.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.538 ' O ' HG12 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -63.02 -55.74 23.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.953 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.1 mm? -74.7 -27.83 60.56 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.731 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 6.7 mt -67.22 -35.93 75.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 121.612 -0.68 . . . . 0.0 110.859 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.09 -32.6 44.74 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.459 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.953 HG21 ' O ' ' B' ' 13' ' ' LEU . 23.2 m -52.57 -35.97 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 176.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.586 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.1 t80 -77.92 -59.03 2.95 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 113.923 -1.489 . . . . 0.0 110.683 179.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.731 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 3.8 mm-40 -49.68 -45.65 49.02 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -47.79 -51.72 21.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.614 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.456 ' CE2' ' O ' ' B' ' 34' ' ' GLU . 3.4 m-85 -81.11 -31.91 34.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.627 0.727 . . . . 0.0 110.294 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.586 ' HB1' ' O ' ' B' ' 17' ' ' PHE . . . -86.74 20.12 2.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.931 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -158.06 106.93 0.3 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.324 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.61 -50.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.763 0.316 . . . . 0.0 111.106 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -160.88 153.19 20.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.65 -92.07 0.51 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.593 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -109.64 169.44 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.864 0.364 . . . . 0.0 110.892 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 66.8 m -161.4 56.98 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.784 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m -116.32 -24.12 3.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.663 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.52 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -140.69 153.19 45.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.291 0.567 . . . . 0.0 111.417 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.564 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.0 OUTLIER -105.96 -154.19 0.51 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.956 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 13.9 t -145.28 138.03 26.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.306 . . . . 0.0 110.462 179.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.478 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.77 -35.92 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.776 -179.694 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.689 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.22 -42.94 58.95 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.456 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.1 OUTLIER -55.94 -28.96 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.059 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.562 ' CD2' HD22 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -72.26 -32.61 66.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.028 178.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.689 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -49.96 -59.07 4.23 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.594 0.712 . . . . 0.0 110.863 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.97 -44.09 93.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.631 -178.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.445 ' HB2' ' CZ ' ' B' ' 20' ' ' TYR . 31.9 t80 -58.16 -29.65 65.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.435 ' CE ' ' CD1' ' B' ' 83' ' ' LEU . 1.1 ttm -78.03 -46.64 20.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.946 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.51 -19.63 63.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.082 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 5.9 t -94.45 -35.32 12.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' B' ' 43' ' ' LEU . 0.1 OUTLIER -128.86 20.3 5.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.804 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 13.7 mt -161.85 44.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.036 0.446 . . . . 0.0 110.413 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.44 -24.09 57.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.814 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.67 -13.98 62.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.246 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.44 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.1 m-85 -111.03 11.12 22.09 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.419 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 30.0 p -141.6 -34.87 0.47 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -41.0 -79.69 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.718 0.294 . . . . 0.0 111.718 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.07 -18.04 55.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.174 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 67.83 23.68 8.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.747 0.308 . . . . 0.0 110.997 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -61.16 141.16 57.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.501 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.64 ' HB3' ' CG1' ' B' ' 55' ' ' VAL . 10.1 t0 64.31 103.55 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.483 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -86.82 22.73 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.75 2.3 . . . . 0.0 113.185 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -127.6 -0.54 6.69 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.081 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.64 ' CG1' ' HB3' ' B' ' 52' ' ' ASP . 1.6 m -84.57 -51.1 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.154 0.502 . . . . 0.0 110.834 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.472 ' N ' ' CG2' ' B' ' 55' ' ' VAL . 0.1 OUTLIER -75.03 -51.91 12.39 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.944 -179.434 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -56.56 -29.27 61.81 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.282 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -52.19 66.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.245 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.733 ' HB2' ' HA ' ' B' ' 79' ' ' LEU . 2.9 ptp -54.89 -52.9 61.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 111.236 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.493 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -62.72 -27.7 69.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.36 -179.486 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -40.14 38.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.423 . . . . 0.0 110.446 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -80.15 -22.73 41.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.177 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.519 ' CD2' HD13 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -58.33 -46.07 86.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.068 0.461 . . . . 0.0 110.599 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 t70 65.13 49.31 2.03 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.954 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.439 HD23 ' HB3' ' B' ' 63' ' ' LEU . 2.3 mm? -51.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.051 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -175.02 -56.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.5 p -70.31 136.28 49.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.937 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 77.1 -50.25 0.55 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.871 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.49 21.19 20.21 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.057 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.52 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 -159.92 166.72 29.59 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.97 0.414 . . . . 0.0 111.324 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.564 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -66.36 -139.02 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.212 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.504 ' C ' ' OE1' ' B' ' 75' ' ' GLU . 4.4 p-10 172.47 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.383 0.538 . . . . 0.0 111.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.565 ' CG ' HG13 ' A' ' 85' ' ' VAL . 29.7 p90 -84.45 -59.92 2.23 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -178.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.51 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.8 tp60 -76.94 -35.11 57.51 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.608 ' N ' ' OE1' ' B' ' 75' ' ' GLU . 0.8 OUTLIER -49.25 -26.63 3.11 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.925 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.559 ' CG ' ' HB2' ' B' ' 17' ' ' PHE . 1.1 t80 -77.25 -54.08 6.93 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.5 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 8.0 mt -57.77 -33.51 68.58 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.403 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.3 OUTLIER -76.71 -43.35 37.88 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 2.7 mp -58.2 -57.46 12.78 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.796 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.548 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.92 -44.18 28.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.09 179.406 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.5 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -50.11 51.66 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.178 -1.01 . . . . 0.0 110.747 179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.463 ' O ' HG21 ' B' ' 85' ' ' VAL . . . -51.32 -41.16 47.18 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.375 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.537 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 6.4 mt -57.87 -46.85 84.23 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.412 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.47 -31.98 62.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.143 0.497 . . . . 0.0 111.205 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.565 HG13 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.15 -17.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.586 -179.469 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.96 14.01 18.37 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.162 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.44 ' HB3' ' CD2' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -156.12 -37.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.321 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.412 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.1 t60 -91.02 157.98 16.95 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.879 0.371 . . . . 0.0 111.118 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.38 93.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.975 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.6 m -150.43 -67.69 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -121.11 -32.59 3.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.96 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -51.86 -25.99 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.53 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.5 50.79 1.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.951 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -154.84 -46.28 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.217 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -135.38 65.14 62.09 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.449 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 48.8 Cg_exo -57.64 -46.78 24.73 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.673 2.249 . . . . 0.0 112.648 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 86.3 Cg_endo -81.09 -39.38 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.41 2.073 . . . . 0.0 112.345 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.51 147.51 48.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.911 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.65 104.15 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.03 99.53 0.64 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.86 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.834 179.98 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.805 0.336 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.6 87.46 5.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.848 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -71.4 -2.86 11.92 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.003 2.468 . . . . 0.0 113.459 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -139.21 145.52 39.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.476 0.655 . . . . 0.0 111.702 -179.746 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.48 -48.97 37.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.755 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.472 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.4 m -60.49 -37.57 81.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.078 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.7 -36.64 47.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.46 -26.96 41.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.342 178.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -65.37 -45.31 84.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.288 -179.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.576 ' O ' HG13 ' A' ' 14' ' ' ILE . 3.2 mp -63.05 -56.77 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.46 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.547 ' HA ' HD11 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.72 -179.455 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.459 ' O ' HG12 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.74 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.871 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.896 ' O ' HG21 ' A' ' 16' ' ' VAL . 4.0 mm? -71.97 -27.22 62.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.851 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.8 mt -66.9 -36.02 76.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.944 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.75 -35.67 60.11 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.35 -1.296 . . . . 0.0 112.473 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.896 HG21 ' O ' ' A' ' 13' ' ' LEU . 19.9 m -56.82 -35.68 47.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.479 0.657 . . . . 0.0 109.742 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.621 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 14.6 t80 -80.22 -59.91 2.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.757 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.851 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.3 OUTLIER -66.51 -29.63 69.77 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.335 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.43 -51.68 52.71 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.323 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.44 ' HB3' HD22 ' A' ' 30' ' ' LEU . 2.0 m-85 -80.35 -40.03 27.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.69 0.757 . . . . 0.0 109.538 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.666 ' HB1' ' HA ' ' A' ' 18' ' ' GLN . . . -56.89 -24.47 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.608 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 169.35 86.85 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.443 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 -40.61 65.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.292 . . . . 0.0 110.833 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.25 100.98 8.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.29 -163.72 12.95 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -58.42 -178.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.778 0.323 . . . . 0.0 110.892 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.38 97.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.12 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p -113.37 -39.8 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.461 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.8 p -136.4 -177.45 4.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.71 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.445 ' HG ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -129.68 -128.24 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.632 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.97 130.47 0.79 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.407 ' N ' HD22 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -49.75 -41.33 43.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.944 0.402 . . . . 0.0 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.682 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.33 -43.42 56.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.431 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 1.7 mt-10 -55.82 -29.15 59.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.01 0.433 . . . . 0.0 110.428 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.509 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 6.8 t80 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.371 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.76 -59.04 5.61 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.686 0.755 . . . . 0.0 111.3 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.24 -32.52 68.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.274 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -57.78 -38.18 75.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.468 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -74.61 -35.4 62.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.201 0.524 . . . . 0.0 110.338 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -73.27 -19.25 61.1 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.46 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.7 t -107.65 -43.57 4.47 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -178.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -127.85 -18.42 4.26 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -176.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.468 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 9.4 mt -120.27 49.56 1.41 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.273 0.559 . . . . 0.0 110.183 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -82.93 -29.37 29.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.926 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.75 30.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.59 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.413 ' CE1' ' HB3' ' A' ' 87' ' ' CYS . 47.8 m-85 -95.79 20.48 9.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t 178.43 39.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.745 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -102.09 -39.16 7.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.54 -25.01 14.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.784 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.41 41.72 4.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.082 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -51.29 -27.84 10.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.659 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -153.15 126.04 4.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.418 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.46 23.87 0.8 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.645 2.23 . . . . 0.0 112.88 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.421 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -124.32 4.3 8.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.976 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 59' ' ' MET . 53.9 t -84.3 -63.99 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.946 0.373 . . . . 0.0 111.392 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 60' ' ' MET . 0.1 OUTLIER -76.51 -52.57 9.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.066 0.46 . . . . 0.0 112.017 -179.491 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.405 ' N ' ' CD2' ' A' ' 56' ' ' LEU . 10.2 t0 -55.38 -59.08 5.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.196 -178.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 7.6 mmt180 -58.8 -35.59 73.09 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.706 ' SD ' ' HA ' ' A' ' 79' ' ' LEU . 3.2 tmm? -75.51 -43.78 47.18 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 120.426 0.155 . . . . 0.0 111.413 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.478 ' HG3' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -66.59 -37.35 84.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.856 0.36 . . . . 0.0 110.443 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.8 mtpt -78.4 -46.75 19.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.111 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.19 6.1 12.69 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.842 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.406 ' HB2' ' CD2' ' A' ' 79' ' ' LEU . 0.5 OUTLIER -60.23 -11.4 6.23 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.404 ' N ' HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER 78.48 91.05 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.873 0.368 . . . . 0.0 110.979 179.792 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.57 55.05 1.91 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.685 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -78.27 64.68 3.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.908 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.54 29.96 17.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.997 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -61.31 -46.91 88.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.811 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 139.71 77.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.525 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.461 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.4 OUTLIER 61.47 -170.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.697 0.284 . . . . 0.0 110.865 179.884 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 0.5 OUTLIER -65.0 -137.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.581 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 22.9 t70 171.78 161.24 0.1 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.436 0.562 . . . . 0.0 111.492 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.53 ' CG ' HG11 ' B' ' 85' ' ' VAL . 35.9 p90 -52.14 -59.77 3.99 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.644 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.463 HE22 ' HB2' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -79.66 -22.9 42.94 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.261 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.682 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.4 tt0 -45.41 -43.68 11.45 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.51 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.6 t80 -71.32 -54.41 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.301 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.4 mt -51.19 -38.56 52.99 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.183 0.516 . . . . 0.0 109.74 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.463 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -36.72 57.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.494 -0.776 . . . . 0.0 108.991 178.028 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.719 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -65.27 -57.54 8.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.288 -179.514 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.534 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.89 -43.84 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 178.636 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.441 ' N ' HG21 ' A' ' 80' ' ' ILE . . . -54.2 -50.99 53.68 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.65 179.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.431 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.05 -41.64 60.27 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.867 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 3.3 mt -61.86 -42.26 98.84 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.42 -32.43 57.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.374 0.607 . . . . 0.0 110.188 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.529 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.67 -17.78 9.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.553 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -112.87 14.5 19.81 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.143 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.413 ' HB3' ' CE1' ' A' ' 46' ' ' PHE . 52.8 t -157.94 -42.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.926 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -90.31 162.93 14.95 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.872 0.368 . . . . 0.0 110.963 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.18 112.64 1.79 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.081 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.65 -53.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -127.39 -45.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.691 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 30.8 m -60.26 -34.14 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.39 9.7 30.58 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -137.2 29.38 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.011 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.441 ' N ' ' HD3' ' A' ' 96' ' ' PRO . . . -129.54 57.94 34.07 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.566 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.501 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 52.6 Cg_exo -53.92 -47.12 28.86 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.332 2.021 . . . . 0.0 112.386 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.501 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 12.1 Cg_exo -69.57 -32.28 19.67 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.349 2.032 . . . . 0.0 111.581 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.28 87.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.82 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.2 pttt -104.52 148.29 26.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.016 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -34.22 61.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.94 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.914 179.955 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.833 0.349 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.53 87.45 5.98 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -71.44 -2.86 11.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 123.007 2.471 . . . . 0.0 113.414 -179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.46 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -139.14 145.48 39.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.475 0.655 . . . . 0.0 111.713 -179.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.37 -49.07 36.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.752 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.472 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.4 m -60.44 -37.55 81.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.089 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.46 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -36.69 48.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.008 0.432 . . . . 0.0 110.274 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -26.95 42.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.413 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.5 OUTLIER -65.44 -45.3 84.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.227 -179.664 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.565 ' O ' HG13 ' B' ' 14' ' ' ILE . 3.2 mp -63.1 -56.75 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.434 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.532 ' HA ' HD11 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.702 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.456 ' O ' HG12 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.86 13.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.905 ' O ' HG21 ' B' ' 16' ' ' VAL . 4.0 mm? -71.92 -27.16 62.64 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.86 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.8 mt -66.92 -36.04 76.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 O-C-N 121.751 -0.593 . . . . 0.0 110.998 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.76 60.36 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 112.474 -176.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.905 HG21 ' O ' ' B' ' 13' ' ' LEU . 20.1 m -56.85 -35.63 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.458 0.647 . . . . 0.0 109.748 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.619 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 14.8 t80 -80.16 -59.98 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.737 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.86 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.3 OUTLIER -66.44 -29.68 69.87 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.47 -51.68 52.96 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.318 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.452 ' HB3' HD22 ' B' ' 30' ' ' LEU . 2.0 m-85 -80.3 -39.99 27.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.708 0.766 . . . . 0.0 109.66 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.673 ' HB1' ' HA ' ' B' ' 18' ' ' GLN . . . -56.91 -24.41 52.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.623 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . 169.37 86.78 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.459 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -40.63 65.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.899 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.25 101.05 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.864 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.29 -163.71 12.96 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.547 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -58.41 -178.35 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.705 0.288 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.46 98.01 0.79 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.9 p -113.52 -39.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.776 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.438 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.6 p -136.4 -177.39 4.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.609 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.452 HD22 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -129.67 -128.24 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.61 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.96 130.5 0.79 Allowed 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.409 ' N ' HD22 ' B' ' 71' ' ' LEU . 0.0 OUTLIER -49.75 -41.31 43.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.017 -179.533 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.681 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.36 -43.33 57.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.997 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 1.7 mt-10 -55.99 -29.02 59.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.079 0.466 . . . . 0.0 110.425 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 6.9 t80 -72.77 -27.0 61.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.289 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.681 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.64 -59.02 5.62 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.597 0.713 . . . . 0.0 111.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.51 68.39 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.303 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.78 -38.2 75.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.472 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -74.65 -35.33 62.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.154 0.502 . . . . 0.0 110.326 179.459 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -73.28 -19.17 61.11 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.476 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 3.7 t -107.61 -43.71 4.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -178.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -127.76 -18.53 4.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' B' ' 39' ' ' MET . 9.4 mt -120.14 49.51 1.4 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.312 0.577 . . . . 0.0 110.304 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -82.94 -29.3 29.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.919 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.74 30.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.57 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.42 ' CD1' ' HB3' ' B' ' 87' ' ' CYS . 47.4 m-85 -95.86 20.52 9.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.725 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.7 t 178.47 39.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.709 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -102.11 -39.07 7.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.896 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.56 -25.01 14.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.736 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.49 41.64 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -51.26 -27.79 10.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.75 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -153.23 126.01 4.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.436 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.45 24.03 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.572 2.181 . . . . 0.0 112.921 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.43 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -124.37 4.16 8.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.922 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 54.2 t -84.28 -63.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.977 0.389 . . . . 0.0 111.377 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.407 ' CD2' ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -76.49 -52.59 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.056 0.455 . . . . 0.0 112.03 -179.532 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.407 ' N ' ' CD2' ' B' ' 56' ' ' LEU . 10.2 t0 -55.34 -59.07 5.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.273 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 7.6 mmt180 -58.8 -35.68 73.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.704 ' SD ' ' HA ' ' B' ' 79' ' ' LEU . 3.2 tmm? -75.38 -43.88 47.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.436 0.16 . . . . 0.0 111.41 -179.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.474 ' HG3' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -66.55 -37.42 84.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.858 0.361 . . . . 0.0 110.428 179.793 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -78.33 -46.78 19.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 6.13 12.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.888 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.4 ' O ' ' CB ' ' B' ' 64' ' ' ASP . 0.5 OUTLIER -60.26 -11.39 6.27 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . 0.4 ' CB ' ' O ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER 78.58 90.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.779 0.323 . . . . 0.0 111.01 179.781 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.56 55.1 1.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.68 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -78.25 64.7 3.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.883 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.55 29.88 17.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.986 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -61.28 -46.93 88.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.828 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 139.73 77.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.51 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.438 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.4 OUTLIER 61.4 -170.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.868 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' B' ' 72' ' ' ASP . 0.5 OUTLIER -65.1 -138.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.588 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 22.8 t70 171.78 161.3 0.1 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.453 0.569 . . . . 0.0 111.462 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.529 ' CG ' HG11 ' A' ' 85' ' ' VAL . 35.6 p90 -52.16 -59.79 3.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.626 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.456 HE22 ' HB2' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -79.69 -22.91 42.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.16 -179.32 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.677 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.4 tt0 -45.42 -43.7 11.49 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.52 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.6 t80 -71.3 -54.39 10.99 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.356 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 5.3 mt -51.21 -38.65 53.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.195 0.521 . . . . 0.0 109.667 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.456 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.37 -36.58 58.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.049 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.721 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -65.36 -57.63 7.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.264 -179.564 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.524 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.71 -43.82 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.419 178.619 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.441 ' N ' HG21 ' B' ' 80' ' ' ILE . . . -54.13 -51.0 53.35 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.141 -1.028 . . . . 0.0 110.705 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.431 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.07 -41.64 60.46 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.895 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 3.4 mt -61.91 -42.28 98.91 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.27 -32.53 56.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.53 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.621 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -113.01 14.58 19.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.077 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.42 ' HB3' ' CD1' ' B' ' 46' ' ' PHE . 52.9 t -158.03 -42.27 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 14.8 t-80 -90.32 162.93 14.94 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.821 0.343 . . . . 0.0 110.972 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.21 112.61 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.67 -53.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -127.54 -45.58 1.48 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.711 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 30.9 m -60.25 -34.13 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.41 9.71 30.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.953 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -137.27 29.34 2.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.987 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.434 ' N ' ' HD3' ' B' ' 96' ' ' PRO . . . -129.49 57.95 34.08 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.487 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 52.7 Cg_exo -53.93 -47.07 29.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.335 2.024 . . . . 0.0 112.482 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.487 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 12.1 Cg_exo -69.6 -32.19 19.73 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.306 2.004 . . . . 0.0 111.658 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.36 87.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.797 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -104.45 148.27 26.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -34.33 61.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.331 -0.842 . . . . 0.0 110.827 -179.95 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.828 0.347 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.19 128.18 0.92 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -68.3 -102.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.732 2.288 . . . . 0.0 112.196 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.441 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -170.75 144.26 2.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.351 0.596 . . . . 0.0 111.156 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.96 -49.07 11.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.998 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.499 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 0.6 OUTLIER -62.55 -40.42 96.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.087 179.121 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.441 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.1 -36.64 41.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.633 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.67 -26.89 40.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.707 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' ' 6' ' ' THR . 1.6 p -66.86 -42.2 86.08 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.513 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.653 HG12 HD12 ' B' ' 80' ' ' ILE . 3.5 mp -70.98 -54.65 16.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.776 0.322 . . . . 0.0 111.682 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.94 -27.28 12.63 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -178.606 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.521 ' O ' HG13 ' A' ' 16' ' ' VAL . 16.6 m -75.73 -55.87 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.777 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.788 ' O ' HG23 ' A' ' 16' ' ' VAL . 3.8 mm? -58.82 -27.06 64.72 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.85 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 8.8 mt -73.54 -38.67 52.85 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 CA-C-O 121.489 0.661 . . . . 0.0 110.357 178.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 19' ' ' LYS . . . -73.63 -37.15 65.46 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.787 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.788 HG23 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -56.81 -36.29 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-O 121.463 0.649 . . . . 0.0 109.815 178.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.595 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 4.2 t80 -79.81 -59.92 2.55 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.664 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.85 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.5 OUTLIER -64.42 -39.45 93.86 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.603 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 11.7 tppt? -47.89 -50.69 25.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.812 0.339 . . . . 0.0 110.817 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.51 ' CG ' ' CD2' ' A' ' 38' ' ' PHE . 0.8 OUTLIER -79.35 -39.83 31.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.769 0.795 . . . . 0.0 109.344 178.464 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.684 ' HB2' ' HA ' ' A' ' 18' ' ' GLN . . . -59.36 -19.02 43.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.24 -1.345 . . . . 0.0 112.063 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -119.69 -35.95 0.87 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.627 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt 68.18 -66.72 0.22 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.788 0.328 . . . . 0.0 110.692 -179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -110.18 27.72 9.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.764 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.49 -97.39 0.18 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.519 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -171.95 136.17 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -140.55 25.93 2.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.192 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.433 ' O ' ' OG1' ' A' ' 29' ' ' THR . 28.5 t 64.59 135.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.215 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 28' ' ' VAL . 3.5 p 56.33 154.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.817 -0.628 . . . . 0.0 111.375 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.49 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -101.99 -128.9 0.23 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.27 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -171.81 123.79 0.53 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.413 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.68 -36.33 24.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.128 -179.244 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.652 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.21 -42.0 60.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.646 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.38 -28.59 68.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.114 0.483 . . . . 0.0 109.963 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -72.05 -31.62 66.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.958 179.166 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.652 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -50.87 -59.17 4.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.683 0.754 . . . . 0.0 111.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -55.18 28.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.446 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.51 ' CD2' ' CG ' ' A' ' 20' ' ' TYR . 21.2 m-85 -57.91 -35.6 71.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.166 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.407 ' CE ' ' CD1' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -72.61 -27.6 62.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.602 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.6 m-20 -73.71 -19.6 60.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.719 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.49 -80.74 0.58 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.669 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.39 -30.66 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.781 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.407 ' CD1' ' CE ' ' A' ' 39' ' ' MET . 30.5 mt -133.64 51.67 2.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.004 0.43 . . . . 0.0 110.761 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.78 -41.49 30.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.884 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.87 24.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.245 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -82.6 -40.53 20.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.482 ' OG1' ' N ' ' A' ' 48' ' ' LYS . 29.9 p -88.81 -84.93 0.2 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.807 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.482 ' N ' ' OG1' ' A' ' 47' ' ' THR . 6.4 mmmt 36.56 -96.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.831 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -157.92 43.87 0.32 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.897 0.38 . . . . 0.0 110.662 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -52.65 -178.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.133 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.54 27.16 3.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.824 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -145.07 101.23 4.49 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.766 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.23 2.2 7.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.527 2.152 . . . . 0.0 112.862 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.45 -23.16 24.83 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.821 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.6 t -47.99 -61.44 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.771 0.32 . . . . 0.0 111.406 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.582 ' O ' ' HG2' ' A' ' 59' ' ' MET . 10.8 tp -68.69 -45.11 72.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.557 0.694 . . . . 0.0 110.465 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 1.8 t70 -55.6 -26.51 44.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.846 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.14 -53.67 10.43 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.471 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.712 ' HE1' ' O ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -55.92 -53.79 52.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.004 0.431 . . . . 0.0 111.633 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.514 ' H ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -65.14 -22.8 66.98 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.083 -179.097 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -67.87 -61.08 2.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.849 0.357 . . . . 0.0 111.416 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.86 -26.42 68.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.578 ' HB2' HD11 ' A' ' 79' ' ' LEU . 1.7 tt -60.16 -19.24 52.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t70 63.93 54.9 1.66 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 0.0 109.864 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.433 ' N ' HD21 ' A' ' 63' ' ' LEU . 35.7 mt -39.13 113.38 0.31 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.876 -179.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -153.02 133.33 13.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.697 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.7 m -77.17 -22.61 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.229 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -94.13 42.71 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.844 0.354 . . . . 0.0 110.978 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' O ' ' HG2' ' A' ' 70' ' ' GLN . . . -154.93 -119.54 0.68 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.516 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 69' ' ' GLY . 1.5 mm-40 167.46 167.25 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.762 0.315 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.458 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -70.39 -138.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.136 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.427 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 0.5 OUTLIER 172.39 179.04 0.08 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 118.516 0.598 . . . . 0.0 111.715 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.598 ' HB2' HG13 ' B' ' 85' ' ' VAL . 44.2 p90 -64.78 -57.65 8.35 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.336 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -78.81 -20.99 48.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.076 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.407 ' O ' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -45.1 -36.86 3.87 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 35' ' ' PHE . 2.9 t80 -80.2 -54.24 5.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.799 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.428 ' O ' ' HA3' ' A' ' 81' ' ' GLY . 7.2 mt -51.83 -34.09 38.9 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.175 0.512 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.41 -48.99 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.223 178.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.712 ' O ' ' HE1' ' A' ' 59' ' ' MET . 5.3 mp -59.78 -58.19 9.65 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.868 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.634 HD12 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -71.24 -46.46 65.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.843 179.576 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.35 50.53 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.102 -1.047 . . . . 0.0 110.525 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -52.11 -32.79 36.29 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.583 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.546 ' CD2' ' HE1' ' A' ' 59' ' ' MET . 14.1 mt -64.48 -46.6 82.32 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 120.901 0.381 . . . . 0.0 110.12 179.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.463 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.09 -32.87 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.625 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.594 HG13 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.6 9.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.403 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.94 12.75 14.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.671 -179.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.491 ' N ' ' O ' ' A' ' 83' ' ' LEU . 53.6 t -152.45 -43.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.879 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -84.11 148.82 26.59 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.75 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.36 85.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.213 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' PHE . 41.0 p -179.59 102.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.744 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CB ' ' O ' ' A' ' 90' ' ' SER . 0.5 OUTLIER 82.85 -30.13 0.09 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.8 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.4 t -52.33 100.84 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 tttp 54.48 28.63 9.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.112 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.73 54.07 6.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.148 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.436 ' CB ' ' CD ' ' A' ' 96' ' ' PRO . . . -64.01 -64.25 3.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.097 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.463 ' HG2' ' HD3' ' A' ' 97' ' ' PRO . 0.9 OUTLIER -40.78 -54.17 2.52 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.405 2.736 . . . . 0.0 113.242 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.463 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 44.4 Cg_endo -67.41 -9.75 26.36 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.354 2.036 . . . . 0.0 112.712 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -94.25 29.8 2.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.33 . . . . 0.0 111.183 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.8 mttm 57.23 -169.89 0.1 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.078 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 75.2 ttt-85 -83.65 -66.87 0.84 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 38.6 p90 . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.914 -179.954 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 95.1 p . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.809 0.337 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.17 128.16 0.92 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.978 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -68.26 -102.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.715 2.276 . . . . 0.0 112.273 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' THR . . . . . 0.445 ' CG2' ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -170.72 144.24 2.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 111.145 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -49.11 11.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.998 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.499 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 0.6 OUTLIER -62.44 -40.44 96.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.025 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.445 ' HB2' ' CG2' ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.16 -36.58 41.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.61 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.77 -26.88 40.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.66 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.479 ' SG ' ' O ' ' B' ' 6' ' ' THR . 1.6 p -66.79 -42.26 86.28 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.519 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.634 HG12 HD12 ' A' ' 80' ' ' ILE . 3.5 mp -71.04 -54.63 16.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.597 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.554 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.01 -27.27 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.529 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.513 ' O ' HG13 ' B' ' 16' ' ' VAL . 16.6 m -75.67 -55.83 5.27 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.909 -0.317 . . . . 0.0 111.833 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.783 ' O ' HG23 ' B' ' 16' ' ' VAL . 3.8 mm? -58.83 -27.17 64.85 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.856 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 8.8 mt -73.44 -38.73 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 CA-C-O 121.433 0.635 . . . . 0.0 110.34 178.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' B' ' 19' ' ' LYS . . . -73.62 -37.1 65.49 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.824 -177.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.783 HG23 ' O ' ' B' ' 13' ' ' LEU . 18.8 m -56.85 -36.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.429 0.633 . . . . 0.0 109.81 178.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.587 ' O ' ' HB2' ' B' ' 21' ' ' ALA . 4.2 t80 -79.8 -60.03 2.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.661 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.5 OUTLIER -64.34 -39.48 93.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.602 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' B' ' 15' ' ' ALA . 11.7 tppt? -47.9 -50.68 25.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.852 0.358 . . . . 0.0 110.888 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.517 ' CG ' ' CD2' ' B' ' 38' ' ' PHE . 0.8 OUTLIER -79.25 -39.88 31.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.8 0.81 . . . . 0.0 109.335 178.404 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.668 ' HB2' ' HA ' ' B' ' 18' ' ' GLN . . . -59.45 -19.04 44.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.985 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -119.74 -35.74 0.89 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.663 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt 68.19 -66.75 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.676 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -110.12 27.65 9.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.767 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.48 -97.28 0.18 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.525 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -171.99 136.08 0.86 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.803 0.335 . . . . 0.0 110.802 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 29.6 t -140.49 25.91 2.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.142 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . 0.425 ' O ' ' OG1' ' B' ' 29' ' ' THR . 28.8 t 64.67 135.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.221 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.425 ' OG1' ' O ' ' B' ' 28' ' ' VAL . 3.7 p 56.39 154.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.392 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.491 ' HA ' ' HA ' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -102.02 -128.91 0.23 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.255 -179.846 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -171.76 123.83 0.54 Allowed 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.413 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.64 -36.38 24.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.087 -179.207 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.653 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.16 -42.11 60.45 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.28 -28.69 68.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 109.925 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -71.95 -31.72 66.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.207 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -50.81 -59.26 4.29 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.588 0.709 . . . . 0.0 111.49 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -55.14 29.45 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.578 -1.192 . . . . 0.0 111.527 -178.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.517 ' CD2' ' CG ' ' B' ' 20' ' ' TYR . 21.1 m-85 -57.87 -35.65 71.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.146 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.4 ' CE ' ' CD1' ' B' ' 43' ' ' LEU . 0.1 OUTLIER -72.63 -27.61 62.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.541 179.597 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 25.6 m-20 -73.62 -19.7 60.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.7 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.37 -80.93 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.668 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.28 -30.6 3.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.848 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.4 ' CD1' ' CE ' ' B' ' 39' ' ' MET . 30.3 mt -133.74 51.65 2.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.813 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.74 -41.53 30.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.835 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.8 23.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -82.73 -40.52 20.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.48 ' OG1' ' N ' ' B' ' 48' ' ' LYS . 30.0 p -88.76 -84.93 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.48 ' N ' ' OG1' ' B' ' 47' ' ' THR . 6.5 mmmt 36.58 -96.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -157.89 43.87 0.32 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.817 0.342 . . . . 0.0 110.624 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -52.62 -178.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.103 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.59 27.18 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.867 179.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -145.1 101.29 4.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.23 2.13 7.56 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.617 2.211 . . . . 0.0 112.839 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.47 -23.17 24.74 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.767 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 34.1 t -48.04 -61.41 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.696 0.284 . . . . 0.0 111.409 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.574 ' O ' ' HG2' ' B' ' 59' ' ' MET . 10.7 tp -68.66 -45.11 72.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.578 0.704 . . . . 0.0 110.502 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 1.8 t70 -55.49 -26.6 43.56 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.856 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.21 -53.65 10.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.387 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.711 ' HE1' ' O ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -55.9 -53.79 52.51 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.018 0.437 . . . . 0.0 111.6 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.534 ' H ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER -65.1 -22.74 66.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.147 -179.135 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -68.02 -61.04 2.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.731 0.3 . . . . 0.0 111.33 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -26.3 68.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.804 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.578 ' HB2' HD11 ' B' ' 79' ' ' LEU . 1.7 tt -60.23 -19.15 53.28 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t70 63.83 54.94 1.7 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.032 0.444 . . . . 0.0 109.907 -179.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.42 ' N ' HD21 ' B' ' 63' ' ' LEU . 35.3 mt -39.07 113.35 0.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.868 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -153.0 133.38 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.653 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 66.3 m -77.29 -22.53 51.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.194 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -94.18 42.71 1.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.864 0.364 . . . . 0.0 110.977 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.433 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . -154.9 -119.6 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.363 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' B' ' 69' ' ' GLY . 1.5 mm-40 167.38 167.23 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.459 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.2 OUTLIER -70.41 -138.16 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.209 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.428 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.5 OUTLIER 172.38 179.13 0.08 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.463 0.574 . . . . 0.0 111.746 179.723 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.594 ' HB2' HG13 ' A' ' 85' ' ' VAL . 43.9 p90 -64.75 -57.73 8.15 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.349 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -78.85 -20.91 48.47 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.027 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.409 ' O ' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -45.04 -37.01 3.82 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.765 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 3.0 t80 -80.21 -54.16 6.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.792 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.417 ' O ' ' HA3' ' B' ' 81' ' ' GLY . 7.3 mt -51.84 -34.04 38.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.194 0.521 . . . . 0.0 109.733 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.454 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.5 -48.98 17.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.172 178.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.711 ' O ' ' HE1' ' B' ' 59' ' ' MET . 5.3 mp -59.8 -58.13 9.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.869 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.653 HD12 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -71.29 -46.42 65.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.84 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.423 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -52.78 -50.4 49.98 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.126 -1.035 . . . . 0.0 110.555 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -52.22 -32.69 36.89 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.6 178.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.537 ' CD2' ' HE1' ' B' ' 59' ' ' MET . 14.2 mt -64.47 -46.58 82.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.979 0.419 . . . . 0.0 110.134 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.454 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.14 -32.89 62.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.603 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.598 HG13 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.52 -17.65 9.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.497 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.92 12.94 14.84 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.67 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.494 ' N ' ' O ' ' B' ' 83' ' ' LEU . 53.6 t -152.55 -43.49 0.1 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.461 ' CG ' HD11 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -84.22 148.83 26.51 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.764 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.39 85.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' B' ' 91' ' ' PHE . 40.8 p -179.52 102.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . 0.424 ' CB ' ' O ' ' B' ' 90' ' ' SER . 0.5 OUTLIER 83.01 -30.15 0.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.765 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 60.3 t -52.37 100.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.915 0.388 . . . . 0.0 111.299 -179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 tttp 54.27 28.76 9.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.174 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . 57.65 54.19 6.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.076 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.436 ' CB ' ' CD ' ' B' ' 96' ' ' PRO . . . -64.01 -64.26 3.03 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.117 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.456 ' HG2' ' HD3' ' B' ' 97' ' ' PRO . 0.9 OUTLIER -40.87 -54.03 2.62 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.381 2.721 . . . . 0.0 113.207 -179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.456 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 43.8 Cg_endo -67.53 -9.69 26.23 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.303 2.002 . . . . 0.0 112.711 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -94.23 29.64 2.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.73 0.3 . . . . 0.0 111.115 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 11.8 mttm 57.33 -169.89 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.089 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -83.75 -66.81 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.895 179.976 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.74 0.305 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -99.87 110.75 60.24 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.04 -100.85 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.633 2.222 . . . . 0.0 112.278 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -175.24 144.97 0.75 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.375 0.607 . . . . 0.0 111.149 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.02 -40.1 6.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.117 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.467 ' O ' ' CD1' ' A' ' 10' ' ' ILE . 1.7 m -70.16 -37.43 75.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.233 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.66 60.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.015 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -77.4 -26.82 52.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.449 ' HA ' ' CB ' ' B' ' 12' ' ' SER . 81.8 m -72.29 -51.87 18.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.64 ' O ' HG13 ' A' ' 14' ' ' ILE . 2.7 mp -52.89 -56.24 8.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.6 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.478 ' HA ' ' CD1' ' A' ' 14' ' ' ILE . 0.3 OUTLIER -52.36 -27.51 15.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -178.846 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.448 ' CB ' ' HA ' ' B' ' 9' ' ' CYS . 0.4 OUTLIER -66.01 -55.71 15.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.977 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -71.19 -27.69 63.69 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.773 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 7.7 mt -67.3 -37.45 79.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.546 0.688 . . . . 0.0 110.882 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.03 -32.88 61.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.376 -176.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.977 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.1 m -52.63 -38.21 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.485 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 4.6 t80 -77.5 -58.05 3.48 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.529 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.773 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -49.13 -35.8 17.41 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.839 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.1 -52.26 59.19 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.294 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.54 ' HB3' HD23 ' A' ' 30' ' ' LEU . 2.8 m-85 -81.28 -47.36 13.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.771 0.796 . . . . 0.0 110.093 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.509 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -56.89 -21.06 26.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.867 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.01 165.1 51.35 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.401 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt 61.22 101.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.801 0.334 . . . . 0.0 110.877 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -162.05 -46.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.87 -37.89 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.603 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -177.26 -39.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 p -57.67 147.76 26.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.979 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -112.37 55.68 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.9 p -133.99 172.75 12.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.297 0.57 . . . . 0.0 110.778 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.54 HD23 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -114.38 -144.76 0.39 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.421 ' N ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -160.63 138.11 9.38 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.531 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -41.53 44.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.101 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.725 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.91 -45.31 61.68 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HB3' HD22 ' A' ' 30' ' ' LEU . 3.6 mt-10 -57.57 -28.95 64.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.156 0.503 . . . . 0.0 109.97 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.451 ' CE2' ' CB ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -67.49 -32.97 74.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.805 178.709 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.725 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -51.01 -59.2 4.41 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.515 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.8 m -54.09 -48.64 70.46 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.593 -178.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.444 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 31.8 t80 -57.92 -27.42 63.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.893 0.377 . . . . 0.0 110.966 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.434 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -73.7 -58.25 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.196 -179.809 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -65.38 -19.36 65.91 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.436 ' CG2' ' HA ' ' A' ' 38' ' ' PHE . 13.3 t -96.08 -31.73 12.88 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' CG2' ' A' ' 41' ' ' THR . 0.9 OUTLIER -129.29 14.67 6.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.826 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 39' ' ' MET . 40.2 mt -161.93 41.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 109.692 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.67 -26.24 57.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.772 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.86 -7.7 36.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.05 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -112.25 -13.84 13.42 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.621 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 p -124.13 -17.49 6.18 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.7 mttm -47.3 126.49 9.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.973 0.416 . . . . 0.0 111.486 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 63.75 13.73 7.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.37 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.66 30.98 0.41 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-O 120.797 0.332 . . . . 0.0 111.39 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -48.68 -29.39 4.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.939 0.4 . . . . 0.0 110.82 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.03 88.27 49.03 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.484 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.4 -1.62 7.66 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.872 2.381 . . . . 0.0 113.051 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.437 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -98.2 -2.15 58.04 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.881 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.6 t -84.48 -63.2 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.916 0.389 . . . . 0.0 111.352 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 59' ' ' MET . 7.0 tp -75.24 -29.54 60.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 111.703 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.561 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 19.4 t0 -76.12 -28.19 57.37 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.643 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 7.2 mtt180 -75.24 -45.21 41.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.697 0.284 . . . . 0.0 111.554 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.695 ' HE3' ' O ' ' A' ' 79' ' ' LEU . 0.9 OUTLIER -54.35 -54.32 42.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 112.077 -179.283 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . 0.681 ' H ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -70.7 -22.72 62.42 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.517 -179.14 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -67.98 -60.91 2.14 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.236 178.931 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -14.17 62.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.953 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.556 ' HG ' ' HG2' ' A' ' 75' ' ' GLU . 4.8 tt -64.05 -8.77 12.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.826 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 63' ' ' LEU . 3.7 t70 82.42 -60.29 0.17 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.963 0.411 . . . . 0.0 110.199 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.468 ' CD2' ' CD2' ' A' ' 63' ' ' LEU . 1.1 mt 67.65 -159.85 0.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.955 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 64.86 150.23 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.831 0.348 . . . . 0.0 110.757 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.7 p -57.02 89.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.104 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -124.63 -44.26 1.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.66 37.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.444 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.6 OUTLIER 57.35 -171.36 0.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.608 0.242 . . . . 0.0 110.768 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.619 ' O ' ' HB3' ' A' ' 72' ' ' ASP . 0.8 OUTLIER -66.43 -146.79 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.396 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.619 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 1.3 p30 170.79 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.221 0.534 . . . . 0.0 112.127 179.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.473 ' CE2' ' CB ' ' B' ' 90' ' ' SER . 0.3 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.698 -178.739 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.453 HE21 ' CB ' ' A' ' 78' ' ' ASN . 37.4 tp60 -66.41 -34.01 76.99 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.603 -178.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.598 ' O ' ' CD2' ' A' ' 79' ' ' LEU . 1.9 tt0 -45.14 -47.09 12.25 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.806 0.336 . . . . 0.0 110.188 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.8 t80 -70.98 -46.45 62.31 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.412 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 81' ' ' GLY . 7.2 mt -56.81 -40.14 75.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.453 ' CB ' HE21 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -39.51 53.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.056 178.183 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.695 ' O ' ' HE3' ' A' ' 59' ' ' MET . 0.1 OUTLIER -60.26 -58.22 9.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.526 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.15 -46.08 45.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.706 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.452 ' N ' ' CG2' ' A' ' 80' ' ' ILE . . . -54.27 -50.33 56.49 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 178.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.471 ' HA2' HG21 ' A' ' 85' ' ' VAL . . . -51.41 -35.53 36.14 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.425 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.564 ' CD2' ' HE3' ' A' ' 59' ' ' MET . 11.3 mt -61.5 -43.9 98.04 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.88 0.371 . . . . 0.0 110.06 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.29 -34.22 63.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.324 0.583 . . . . 0.0 110.942 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.471 HG21 ' HA2' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -84.17 -17.01 10.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.195 -179.682 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.16 13.64 15.77 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.764 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.435 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.5 OUTLIER -157.32 -42.87 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.263 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 20.4 m-70 -75.86 147.67 38.9 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.378 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.35 78.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.477 ' CB ' ' CE2' ' B' ' 73' ' ' PHE . 74.9 m -145.99 -53.55 0.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.623 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.96 -44.97 3.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.743 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.9 m -64.73 -27.23 42.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.317 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -96.29 24.66 5.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.09 27.04 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.282 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.45 ' N ' ' HD3' ' A' ' 96' ' ' PRO . . . -137.43 60.83 28.52 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.286 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.45 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 41.7 Cg_exo -58.53 -46.74 22.34 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.699 2.266 . . . . 0.0 112.859 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 91.4 Cg_endo -80.93 -23.71 5.3 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.351 2.034 . . . . 0.0 112.633 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.55 105.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.07 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -86.43 -176.34 5.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.953 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -87.6 130.46 34.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.824 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.836 0.35 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -99.87 110.78 60.31 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.881 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.03 -100.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.67 2.247 . . . . 0.0 112.319 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -175.16 144.97 0.76 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.16 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.87 -40.29 6.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.081 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.468 ' O ' ' CD1' ' B' ' 10' ' ' ILE . 1.6 m -70.07 -37.47 75.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.227 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -39.67 61.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.028 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -77.44 -26.81 51.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.635 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' CYS . . . . . 0.448 ' HA ' ' CB ' ' A' ' 12' ' ' SER . 81.7 m -72.34 -51.79 19.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.146 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ILE . . . . . 0.643 ' O ' HG13 ' B' ' 14' ' ' ILE . 2.7 mp -52.89 -56.26 8.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.653 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.479 ' HA ' ' CD1' ' B' ' 14' ' ' ILE . 0.3 OUTLIER -52.34 -27.55 15.85 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.455 ' O ' HG11 ' B' ' 16' ' ' VAL . 0.4 OUTLIER -65.89 -55.66 15.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.027 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' LEU . . . . . 0.963 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -71.35 -27.65 63.51 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' ILE . . . . . 0.769 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 7.7 mt -67.31 -37.4 78.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.543 0.687 . . . . 0.0 110.851 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.11 -32.83 61.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.403 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.963 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.9 m -52.64 -38.31 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.498 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 4.5 t80 -77.48 -58.06 3.48 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.092 -1.413 . . . . 0.0 110.486 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.769 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -49.07 -35.85 16.94 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -52.32 58.9 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.204 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' TYR . . . . . 0.536 ' HB3' HD23 ' B' ' 30' ' ' LEU . 2.8 m-85 -81.22 -47.38 13.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.768 0.794 . . . . 0.0 110.152 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.519 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -56.98 -20.92 26.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.897 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -70.15 165.09 51.64 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.327 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt 61.28 101.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -162.14 -46.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.872 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.94 -37.88 0.93 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -177.3 -39.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.831 0.348 . . . . 0.0 110.918 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.5 p -57.6 147.76 26.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.0 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -112.43 55.7 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.175 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.455 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.9 p -133.91 172.77 12.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.294 0.569 . . . . 0.0 110.798 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . 0.536 HD23 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -114.41 -144.74 0.39 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.578 -179.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.419 ' N ' HD21 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -160.65 138.01 9.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.615 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -41.6 44.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.809 0.337 . . . . 0.0 111.045 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' THR . . . . . 0.727 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.86 -45.25 62.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.855 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . 0.452 ' HB3' HD22 ' B' ' 30' ' ' LEU . 3.6 mt-10 -57.61 -28.96 64.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.213 0.53 . . . . 0.0 109.952 179.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' PHE . . . . . 0.456 ' CE2' ' CB ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -67.43 -33.01 74.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.83 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' LEU . . . . . 0.727 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.0 -59.21 4.41 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.437 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 68.9 m -54.2 -48.61 70.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.523 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.445 ' HB2' ' CE1' ' B' ' 20' ' ' TYR . 31.9 t80 -57.88 -27.42 63.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.858 0.361 . . . . 0.0 110.92 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' MET . . . . . 0.429 ' O ' ' N ' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -73.76 -58.19 3.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.209 -179.701 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -65.5 -19.32 65.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.051 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.443 ' CG2' ' HG2' ' B' ' 42' ' ' GLU . 13.3 t -95.98 -31.73 12.93 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' GLU . . . . . 0.443 ' HG2' ' CG2' ' B' ' 41' ' ' THR . 0.9 OUTLIER -129.25 14.54 6.16 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -177.775 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.429 ' N ' ' O ' ' B' ' 39' ' ' MET . 39.5 mt -161.87 41.47 0.14 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.64 -26.26 57.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.799 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.88 -7.6 36.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.036 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -112.28 -13.96 13.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 p -123.93 -17.52 6.26 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -47.24 126.52 9.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.943 0.401 . . . . 0.0 111.524 -179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 63.8 13.62 7.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.64 31.03 0.41 Allowed 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.772 0.32 . . . . 0.0 111.428 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -48.76 -29.36 4.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.941 0.401 . . . . 0.0 110.761 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.0 88.31 49.02 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.513 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.45 -1.61 7.69 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.934 2.422 . . . . 0.0 113.021 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -98.22 -2.24 58.0 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.893 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 32.0 t -84.44 -63.21 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.887 0.375 . . . . 0.0 111.332 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.597 ' O ' ' HG3' ' B' ' 59' ' ' MET . 7.0 tp -75.36 -29.5 59.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.657 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . 0.563 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 19.4 t0 -76.05 -28.25 57.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.666 -178.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 7.2 mtt180 -75.23 -45.19 41.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.744 0.307 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' MET . . . . . 0.689 ' HE3' ' O ' ' B' ' 79' ' ' LEU . 0.9 OUTLIER -54.28 -54.42 40.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.169 0.509 . . . . 0.0 112.112 -179.371 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' MET . . . . . 0.666 ' H ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER -70.62 -22.73 62.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.548 -179.124 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . 0.563 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -68.01 -60.93 2.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.916 0.388 . . . . 0.0 110.191 178.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.93 -14.26 62.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.933 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.568 ' HG ' ' HG2' ' B' ' 75' ' ' GLU . 4.8 tt -64.13 -8.67 12.95 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.792 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . 0.439 ' CB ' ' O ' ' B' ' 63' ' ' LEU . 3.7 t70 82.37 -60.28 0.18 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.98 0.419 . . . . 0.0 110.19 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.464 ' CD2' ' CD2' ' B' ' 63' ' ' LEU . 1.1 mt 67.78 -159.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.978 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 64.0 m-20 64.87 150.22 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.86 0.362 . . . . 0.0 110.8 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 3.7 p -57.11 89.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.122 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -124.53 -44.26 1.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.64 37.22 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.499 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.455 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.6 OUTLIER 57.38 -171.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.565 0.221 . . . . 0.0 110.786 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.62 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.8 OUTLIER -66.46 -146.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' ASP . . . . . 0.62 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 1.3 p30 170.72 -169.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.227 0.536 . . . . 0.0 112.147 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.477 ' CE2' ' CB ' ' A' ' 90' ' ' SER . 0.3 OUTLIER -70.15 -63.93 0.99 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.709 -178.785 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' GLN . . . . . 0.457 HE21 ' CB ' ' B' ' 78' ' ' ASN . 37.6 tp60 -66.35 -34.07 77.15 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.561 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . 0.591 ' O ' ' CD2' ' B' ' 79' ' ' LEU . 1.9 tt0 -45.06 -47.2 11.85 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.861 0.362 . . . . 0.0 110.095 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.516 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.9 t80 -71.01 -46.4 62.27 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.356 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' B' ' 81' ' ' GLY . 7.1 mt -56.83 -40.14 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' ASN . . . . . 0.457 ' CB ' HE21 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -39.6 53.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.208 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.689 ' O ' ' HE3' ' B' ' 59' ' ' MET . 0.1 OUTLIER -60.21 -58.23 9.39 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.559 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.514 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.2 -46.09 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.655 178.865 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.447 ' N ' ' CG2' ' B' ' 80' ' ' ILE . . . -54.38 -50.13 57.68 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 178.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' GLY . . . . . 0.488 ' HA2' HG21 ' B' ' 85' ' ' VAL . . . -51.55 -35.43 37.07 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.433 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.565 ' CD2' ' HE3' ' B' ' 59' ' ' MET . 11.3 mt -61.59 -43.94 97.92 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.878 0.371 . . . . 0.0 110.003 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.12 -34.24 63.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.402 0.62 . . . . 0.0 110.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.488 HG21 ' HA2' ' B' ' 82' ' ' GLY . 0.0 OUTLIER -84.32 -16.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.126 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.1 13.59 15.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.775 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.5 OUTLIER -157.29 -42.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' HIS . . . . . 0.511 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 20.2 m-70 -75.96 147.78 38.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.96 0.41 . . . . 0.0 111.305 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.37 78.69 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' SER . . . . . 0.473 ' CB ' ' CE2' ' A' ' 73' ' ' PHE . 74.9 m -146.01 -53.57 0.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.534 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.99 -44.93 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.702 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 8.1 m -64.75 -27.23 42.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.316 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -96.36 24.72 5.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.078 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.05 27.0 0.17 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.333 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.448 ' N ' ' HD3' ' B' ' 96' ' ' PRO . . . -137.51 60.95 28.69 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.243 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' PRO . . . . . 0.448 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 41.7 Cg_exo -58.67 -46.66 22.41 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.619 2.213 . . . . 0.0 112.81 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 91.2 Cg_endo -80.96 -23.62 5.32 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.418 2.079 . . . . 0.0 112.607 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.64 105.46 0.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.019 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.3 mttm -86.37 -176.29 5.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.988 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' ARG . . . . . 0.406 ' HB3' ' CZ ' ' B' ' 100' ' ' ARG . 5.6 ptp180 -87.57 130.49 34.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.882 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.875 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.779 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.519 -0.238 0 CA-C-O 121.477 0.656 . . . . 0.0 111.485 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.75 -41.31 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.211 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.918 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -71.08 -39.41 72.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.227 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.779 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.2 mm-40 -51.92 -53.34 42.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.422 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -65.94 -26.64 67.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.184 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.552 ' SG ' HD22 ' B' ' 13' ' ' LEU . 0.3 OUTLIER -64.92 -49.86 68.75 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.353 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.051 HG22 HD11 ' A' ' 14' ' ' ILE . 2.8 mp -61.47 -57.16 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.744 0.307 . . . . 0.0 111.556 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.907 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -52.89 -27.42 18.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.754 -179.286 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.85 -55.44 22.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.702 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.3 mm? -74.22 -28.61 61.33 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -178.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.051 HD11 HG22 ' A' ' 10' ' ' ILE . 6.3 mt -66.88 -37.06 78.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.336 0.589 . . . . 0.0 111.398 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.93 49.06 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.692 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.3 m -52.24 -37.55 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' A' ' 16' ' ' VAL . 3.5 t80 -77.1 -57.95 3.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.277 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.823 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.3 mm-40 -48.98 -47.21 44.37 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.66 -51.8 20.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.69 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.5 m-85 -81.18 -29.76 34.55 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.617 0.722 . . . . 0.0 110.373 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.684 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -84.11 12.96 5.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.281 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.749 179.9 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 90' ' ' SER . 8.9 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.761 0.315 . . . . 0.0 111.375 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.684 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.2 p -129.86 -172.17 2.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 31' ' ' SER . 0.2 OUTLIER -142.71 -121.77 0.09 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.868 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.572 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -172.31 130.96 0.6 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.801 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.419 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 20.8 mtmt -50.02 -41.39 47.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 111.088 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -55.97 -28.79 58.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.106 0.479 . . . . 0.0 110.133 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -69.63 -31.98 70.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.104 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.704 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.6 mm? -53.12 -59.07 5.01 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.756 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 p -59.58 -41.8 91.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.645 -1.162 . . . . 0.0 111.866 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.662 ' HA ' HG22 ' A' ' 41' ' ' THR . 78.8 t80 -57.87 -46.97 84.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.87 0.367 . . . . 0.0 111.339 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.751 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -59.93 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.188 -179.549 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -73.3 -19.67 60.99 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.95 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.8 t -98.99 -31.07 11.99 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.95 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.3 mt-10 -132.39 23.82 4.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -177.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.912 HD21 HD11 ' B' ' 10' ' ' ILE . 11.8 mt -163.18 52.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.494 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.27 -27.31 59.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.475 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.65 -20.03 59.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 36.7 m-85 -97.61 -30.03 13.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.495 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.3 t . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 86' ' ' ALA . 32.7 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.3 -51.54 13.0 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.726 -179.322 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.844 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.0 t70 -55.28 -38.39 68.53 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.397 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.0 -32.89 61.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.689 0.28 . . . . 0.0 111.685 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.968 ' CE ' HD21 ' A' ' 83' ' ' LEU . 8.3 tmm? -73.95 -53.06 10.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.592 ' HG2' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.658 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.687 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 8.7 mm-40 . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.8 0.333 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.464 ' HB2' ' H ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -62.29 -134.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.032 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 3.0 t0 178.58 -171.15 0.12 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 118.569 0.622 . . . . 0.0 111.623 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.814 ' CD2' HG21 ' B' ' 85' ' ' VAL . 41.3 p90 -83.31 -57.75 3.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.27 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 8.6 tp-100 -76.1 -30.71 58.38 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.78 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.763 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -44.7 -42.32 7.51 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.427 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 1.7 t80 -70.01 -54.37 13.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.936 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.441 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.0 mt -53.58 -33.57 55.29 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.429 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.3 m-20 -74.68 -40.84 61.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.296 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.883 HD13 ' SD ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -65.05 -57.81 7.7 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.64 -42.51 48.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.045 179.125 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.86 -50.94 48.23 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.185 -1.007 . . . . 0.0 111.066 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.56 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.37 -41.82 63.51 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.365 -0.922 . . . . 0.0 111.843 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.968 HD21 ' CE ' ' A' ' 59' ' ' MET . 3.2 mt -61.21 -42.29 98.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -54.46 -33.19 59.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.428 0.632 . . . . 0.0 110.338 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.55 -17.77 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.466 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.518 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.59 13.68 20.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.19 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 10.9 t -154.58 -43.32 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.781 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -93.87 -164.73 1.21 Allowed 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.705 0.288 . . . . 0.0 110.917 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.421 ' O ' ' CB ' ' A' ' 90' ' ' SER . 8.5 mt-10 -58.34 -163.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.908 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.555 ' O ' HG12 ' B' ' 28' ' ' VAL . 0.4 OUTLIER 81.62 -57.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.026 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.13 -45.16 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.788 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.797 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.775 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.434 0.635 . . . . 0.0 111.538 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.67 -41.3 6.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.225 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.932 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -71.13 -39.39 72.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.233 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.775 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.95 -53.35 42.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.834 0.35 . . . . 0.0 110.369 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 53.1 mtm180 -65.88 -26.65 67.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.176 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.553 ' SG ' HD22 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -64.98 -49.84 68.7 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.316 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.104 HG22 HD11 ' B' ' 14' ' ' ILE . 2.8 mp -61.58 -57.07 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.702 0.287 . . . . 0.0 111.56 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.913 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -52.85 -27.5 18.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.728 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.81 -55.51 22.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.948 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.3 mm? -74.16 -28.63 61.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.104 HD11 HG22 ' B' ' 10' ' ' ILE . 6.3 mt -66.92 -37.0 78.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 O-C-N 121.722 -0.611 . . . . 0.0 111.428 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.37 -32.98 49.21 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.823 -1.081 . . . . 0.0 112.729 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.948 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.0 m -52.13 -37.62 22.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.464 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.5 t80 -77.03 -58.02 3.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.137 -1.392 . . . . 0.0 110.252 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.811 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.4 mm-40 -49.03 -47.2 44.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.58 -51.9 19.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.668 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.49 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.5 m-85 -81.1 -29.83 34.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.58 0.705 . . . . 0.0 110.45 178.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -84.03 12.97 5.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.628 -1.169 . . . . 0.0 112.346 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.734 179.835 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 90' ' ' SER . 8.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.751 0.31 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.2 p -129.84 -172.07 2.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.753 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 31' ' ' SER . 0.2 OUTLIER -142.83 -121.7 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.865 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.58 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -172.38 130.96 0.59 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.422 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 20.8 mtmt -49.96 -41.41 46.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.124 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.706 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.982 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.532 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.98 -28.75 58.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.071 0.462 . . . . 0.0 110.121 179.678 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.513 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -69.66 -32.06 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.055 178.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.6 mm? -53.08 -59.03 5.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.803 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' B' ' 41' ' ' THR . 3.1 p -59.63 -41.74 91.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.919 -178.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.646 ' HA ' HG22 ' B' ' 41' ' ' THR . 78.8 t80 -57.88 -46.98 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 111.311 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.75 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -59.91 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 -179.534 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -73.33 -19.7 60.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.448 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.99 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.9 t -98.98 -31.08 11.99 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.99 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.3 mt-10 -132.32 23.84 4.46 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.917 HD21 HD11 ' A' ' 10' ' ' ILE . 11.8 mt -163.18 52.93 0.17 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.002 0.429 . . . . 0.0 110.399 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 -27.33 59.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.485 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.62 -19.92 59.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.598 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 37.0 m-85 -97.74 -30.11 12.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.489 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.3 t . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.519 HG13 ' HB3' ' B' ' 86' ' ' ALA . 32.7 t . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 121.033 0.444 . . . . 0.0 111.47 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.847 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.32 -51.5 13.06 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.727 -179.259 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.847 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.0 t70 -55.36 -38.47 68.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.32 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.89 61.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.731 0.3 . . . . 0.0 111.666 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.967 ' CE ' HD21 ' B' ' 83' ' ' LEU . 8.3 tmm? -74.05 -52.95 11.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.592 ' HG2' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.739 -178.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.408 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 8.7 mm-40 . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.804 0.335 . . . . 0.0 111.464 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.467 ' O ' HG22 ' B' ' 29' ' ' THR . 0.4 OUTLIER -62.36 -134.97 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.95 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 3.1 t0 178.64 -171.12 0.12 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.494 0.588 . . . . 0.0 111.532 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 41.6 p90 -83.2 -57.8 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.274 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.479 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 8.6 tp-100 -76.1 -30.68 58.35 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.761 -179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.758 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -44.75 -42.34 7.63 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.513 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.7 t80 -70.0 -54.28 13.9 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.983 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.0 mt -53.58 -33.6 55.39 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.3 m-20 -74.76 -40.7 61.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.312 178.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.882 HD13 ' SD ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -65.06 -57.84 7.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.434 -179.388 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.73 -42.39 47.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.082 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.43 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.98 -50.89 49.18 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.06 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.34 -41.86 63.27 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.787 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.967 HD21 ' CE ' ' B' ' 59' ' ' MET . 3.2 mt -61.2 -42.23 98.23 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.921 0.391 . . . . 0.0 110.135 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.518 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -54.57 -33.13 59.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.414 0.626 . . . . 0.0 110.327 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.814 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.373 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.519 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -112.71 13.78 19.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.112 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.426 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 10.9 t -154.65 -43.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.841 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -94.09 -164.78 1.21 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.784 0.326 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' B' ' 90' ' ' SER . 8.7 mt-10 -58.34 -163.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.887 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.55 ' O ' HG12 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 81.61 -57.42 0.25 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.012 -179.799 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.11 -45.19 2.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.888 0.375 . . . . 0.0 110.829 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 179.92 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.307 0.575 . . . . 0.0 111.076 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.87 -44.58 9.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.322 -0.853 . . . . 0.0 111.056 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.981 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.2 -40.45 94.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.914 178.888 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -50.98 -36.05 37.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.575 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.73 -26.89 40.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.582 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.626 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.7 p -68.07 -41.95 81.15 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.639 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 3.4 mp -72.09 -54.51 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.53 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.956 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.66 -27.35 11.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.649 ' O ' HG13 ' A' ' 16' ' ' VAL . 52.2 m -77.59 -56.03 4.87 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.771 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.733 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -57.95 -27.85 63.78 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.968 0.413 . . . . 0.0 111.778 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 13.4 mt -71.81 -39.57 68.2 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-O 121.573 0.701 . . . . 0.0 110.512 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -77.47 -38.26 49.62 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.935 -1.484 . . . . 0.0 112.084 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.6 m -52.6 -33.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.47 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 1.6 t80 -80.51 -58.48 3.1 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.943 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.931 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.47 -27.53 64.3 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.899 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -50.28 72.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.202 0.525 . . . . 0.0 109.685 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.529 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 3.1 m-85 -79.44 -28.47 41.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.479 178.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.931 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -80.36 2.19 25.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.016 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.633 179.737 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.465 0.308 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.711 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p -139.29 -179.8 6.08 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.813 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.3 0.19 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.435 -179.698 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 28.8 t -173.63 126.71 0.4 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.121 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -49.82 -36.34 26.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.422 -179.126 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.09 -43.08 58.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.072 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.24 59.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 110.154 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.935 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -72.92 -29.45 63.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.908 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -59.13 -59.24 5.78 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.545 0.688 . . . . 0.0 111.507 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.425 ' O ' HG22 ' A' ' 41' ' ' THR . 33.7 t -68.03 -50.41 55.53 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.464 -178.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.529 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.8 m-85 -57.93 -25.89 61.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.228 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.607 ' HE2' HD13 ' A' ' 43' ' ' LEU . 1.5 ttm -78.17 -53.66 7.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.056 0.455 . . . . 0.0 110.531 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.69 30.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.095 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.937 HG23 ' HG2' ' A' ' 42' ' ' GLU . 9.2 t -96.87 -30.28 13.23 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.937 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -125.94 -42.18 1.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.558 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.664 HD21 HD11 ' B' ' 10' ' ' ILE . 7.4 mt -101.88 34.94 2.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.315 0.579 . . . . 0.0 110.162 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -81.16 -28.84 34.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.924 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.55 -25.54 17.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' ' CE1' ' A' ' 88' ' ' HIS . 4.5 m-85 -102.32 17.05 24.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.088 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.333 -0.137 0 CA-C-O 120.901 0.382 . . . . 0.0 110.992 -179.964 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 86' ' ' ALA . 61.7 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.56 -50.94 63.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.663 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -57.01 -26.69 60.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.064 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -50.05 75.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.827 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE2' HD21 ' A' ' 83' ' ' LEU . 1.3 ptp -56.36 -53.5 56.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.062 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.526 ' N ' ' CG ' ' A' ' 59' ' ' MET . 3.6 mmt . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.891 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.626 0.25 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -63.27 -135.41 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER 172.79 -168.7 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.761 0.71 . . . . 0.0 111.753 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.7 ' CG ' HG11 ' B' ' 85' ' ' VAL . 31.8 p90 -76.21 -60.71 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.612 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.496 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.32 -25.61 39.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.438 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.7 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.4 OUTLIER -46.4 -31.77 2.84 Favored 'General case' 0 CA--C 1.522 -0.124 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.683 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.644 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.5 t80 -80.33 -54.35 5.8 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.856 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 77' ' ' LEU . 7.3 mt -55.95 -33.52 64.81 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.726 179.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.85 -37.46 58.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.935 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.1 mp -66.08 -58.19 6.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.023 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.872 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.08 -44.77 49.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.562 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.474 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.82 -49.31 54.79 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.58 -43.59 53.2 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.363 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.4 mt -56.85 -44.84 82.53 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 110.018 178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.484 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.47 -41.62 73.21 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.186 0.517 . . . . 0.0 110.913 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.695 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -73.74 -17.11 17.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.285 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -109.11 16.37 22.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.565 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 44.8 t -158.38 -35.88 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -118.35 -67.87 0.96 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.688 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.693 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 2.1 mm-40 -36.55 156.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.128 0.49 . . . . 0.0 112.234 -178.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.19 66.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.146 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.41 -48.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.718 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.135 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.217 0 CA-C-O 121.363 0.601 . . . . 0.0 110.966 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.83 -44.66 9.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.998 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.21 -40.43 94.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.824 178.931 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.05 -36.14 38.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.47 -179.826 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.71 -26.82 40.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.636 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.631 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -67.93 -42.15 81.48 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.017 HG22 HD11 ' B' ' 14' ' ' ILE . 3.4 mp -71.93 -54.52 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.629 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.76 -27.23 11.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 52.2 m -77.69 -56.0 4.88 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.819 -0.352 . . . . 0.0 111.755 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.73 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.7 mm? -57.9 -27.8 63.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.991 0.424 . . . . 0.0 111.796 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.017 HD11 HG22 ' B' ' 10' ' ' ILE . 13.7 mt -71.96 -39.58 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 CA-C-O 121.481 0.658 . . . . 0.0 110.417 178.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' ALA . . . . . 0.465 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -77.42 -38.31 49.91 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.967 -1.47 . . . . 0.0 112.105 -176.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.73 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.3 m -52.56 -33.61 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.472 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 1.6 t80 -80.4 -58.66 3.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.436 -1.256 . . . . 0.0 112.897 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.926 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.38 -27.54 64.4 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -50.3 72.12 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.522 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 3.1 m-85 -79.35 -28.55 42.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.515 178.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.926 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -80.4 2.41 25.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.103 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.71 179.747 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.706 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p -139.33 -179.91 6.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.967 0.413 . . . . 0.0 110.773 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.685 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.21 0.19 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.504 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 28.7 t -173.7 126.56 0.39 Allowed 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.812 0.339 . . . . 0.0 110.092 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.435 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.4 OUTLIER -49.68 -36.43 25.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.459 -179.174 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.652 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.07 -43.06 59.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.061 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.504 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.25 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.98 0.419 . . . . 0.0 110.094 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.946 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -72.91 -29.43 63.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.941 179.073 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.652 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -59.19 -59.16 5.91 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.562 0.696 . . . . 0.0 111.565 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.429 ' O ' HG22 ' B' ' 41' ' ' THR . 33.6 t -67.95 -50.42 55.98 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.528 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.522 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.9 m-85 -57.99 -25.96 61.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.129 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.594 ' HE1' HD13 ' B' ' 43' ' ' LEU . 1.5 ttm -78.16 -53.61 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.047 0.451 . . . . 0.0 110.541 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.65 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.149 -179.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.958 HG23 ' HG2' ' B' ' 42' ' ' GLU . 9.2 t -96.83 -30.32 13.23 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.958 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.4 OUTLIER -125.9 -42.15 1.92 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.572 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.678 HD21 HD11 ' A' ' 10' ' ' ILE . 7.4 mt -101.89 34.99 2.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.291 0.567 . . . . 0.0 110.053 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -81.27 -28.77 34.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.903 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.62 -25.51 17.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.801 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.421 ' CZ ' ' CE1' ' B' ' 88' ' ' HIS . 4.5 m-85 -102.29 16.96 24.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.08 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.332 -0.156 0 CA-C-O 120.864 0.364 . . . . 0.0 111.003 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' B' ' 86' ' ' ALA . 62.0 t . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.804 0.335 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.51 -51.06 62.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -56.93 -26.76 60.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.063 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -50.0 75.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.818 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 1.3 ptp -56.34 -53.53 56.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.086 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.529 ' N ' ' CG ' ' B' ' 59' ' ' MET . 3.6 mmt . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.879 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.517 0.199 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -63.39 -135.42 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.484 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 0.8 OUTLIER 172.91 -168.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.819 0.736 . . . . 0.0 111.756 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.695 ' CG ' HG11 ' A' ' 85' ' ' VAL . 31.8 p90 -76.31 -60.62 2.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.568 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.507 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.38 -25.53 39.08 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.441 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.711 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.4 OUTLIER -46.46 -31.75 2.88 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.659 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.5 t80 -80.29 -54.45 5.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.805 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -55.93 -33.54 64.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.68 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -37.43 59.09 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.946 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.1 mp -66.06 -58.2 6.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.111 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.86 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.1 -44.77 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.54 179.047 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.481 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.8 -49.3 54.7 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 178.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.479 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.44 -43.62 52.34 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.44 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.4 mt -56.86 -44.85 82.58 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 110.025 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' GLU . . . -55.45 -41.66 73.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.205 0.526 . . . . 0.0 110.897 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.7 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -73.69 -17.27 17.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.209 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -108.95 16.37 22.7 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.54 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 44.6 t -158.38 -35.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -118.29 -67.79 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.696 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 2.1 mm-40 -36.52 156.47 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.14 66.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.159 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.49 -49.01 0.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.723 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.923 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.687 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.34 0.59 . . . . 0.0 111.254 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.91 -41.78 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.97 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.924 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -67.94 -38.75 83.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.048 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.687 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.4 -33.46 30.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.437 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -27.11 41.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.562 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.572 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.4 p -69.07 -45.16 71.03 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.087 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -65.98 -56.37 15.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.49 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.95 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.17 -27.27 13.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.674 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.542 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -69.84 -55.52 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.923 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.087 HD11 HG22 ' A' ' 10' ' ' ILE . 8.3 mt -69.47 -35.45 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-O 121.216 0.531 . . . . 0.0 110.778 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.37 51.21 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.538 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.923 HG22 ' O ' ' A' ' 13' ' ' LEU . 29.6 m -63.53 -37.11 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.167 0.508 . . . . 0.0 109.943 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.458 ' CE1' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.53 -60.1 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.847 -178.602 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.967 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -58.18 -26.66 63.04 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.443 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.36 -52.16 48.12 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.306 -0.557 . . . . 0.0 109.708 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.646 ' HB3' HD11 ' A' ' 30' ' ' LEU . 2.9 m-85 -80.53 -29.77 37.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.62 0.724 . . . . 0.0 109.235 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.967 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -83.3 20.08 1.38 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.523 -1.217 . . . . 0.0 112.218 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.501 179.931 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.886 0.374 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 5.9 p -146.11 158.76 43.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.09 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -117.39 -156.16 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.893 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.512 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -137.88 136.45 37.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 179.085 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' HD23 ' A' ' 36' ' ' LEU . 21.5 mtmt -49.86 -39.78 40.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.688 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.31 -44.58 51.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.28 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.436 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 1.3 tt0 -59.81 -29.14 68.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 0.0 109.941 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -75.59 -26.61 58.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.552 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.649 ' HB2' ' O ' ' A' ' 33' ' ' THR . 2.4 mm? -51.35 -59.26 4.42 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.686 0.755 . . . . 0.0 110.647 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.15 69.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.477 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 12.5 t80 -57.84 -28.98 64.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.402 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.459 ' CE ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -78.0 -35.94 49.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.055 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.769 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 59.7 m-80 -73.21 -19.78 61.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.212 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.78 -78.57 0.59 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.139 0.495 . . . . 0.0 111.606 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 1.9 mm-40 -51.36 -28.41 12.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.032 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.706 HD21 HD11 ' B' ' 10' ' ' ILE . 39.3 mt -134.57 51.48 2.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 110.478 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.769 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.75 -25.39 53.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.946 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.86 -14.52 63.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.134 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.42 -21.54 15.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.26 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.377 -179.625 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 86' ' ' ALA . 22.9 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.898 0.38 . . . . 0.0 111.386 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -51.1 70.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.756 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.82 -30.89 62.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.372 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -42.75 92.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.008 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.855 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -63.43 -53.54 50.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.339 -179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.523 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.298 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 3.8 mm100 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.695 0.283 . . . . 0.0 111.062 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.606 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -65.9 -136.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.501 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.03 -164.9 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.602 0.637 . . . . 0.0 111.603 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.916 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.3 p90 -81.71 -57.2 3.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.357 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.517 HE22 ' HB3' ' A' ' 77' ' ' LEU . 7.6 tp-100 -80.35 -27.91 38.2 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.325 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -44.78 -36.59 3.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.649 ' CD2' HG23 ' A' ' 16' ' ' VAL . 2.0 t80 -80.38 -54.24 5.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.036 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.635 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.5 mt -50.12 -34.55 22.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -38.46 53.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 75' ' ' GLU . 1.8 mp -63.82 -58.15 7.7 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.798 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.893 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.6 -42.37 63.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.174 178.772 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.92 51.81 Favored Glycine 0 CA--C 1.507 -0.446 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.598 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.54 -40.26 46.91 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.426 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.855 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.3 mt -60.26 -45.53 92.95 Favored 'General case' 0 C--O 1.23 0.056 0 O-C-N 122.571 -0.37 . . . . 0.0 110.327 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.44 -30.76 61.11 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.175 0.512 . . . . 0.0 110.843 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.91 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.99 -17.48 9.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.168 -179.657 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.718 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.31 12.83 17.7 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.199 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.14 -37.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.506 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.1 OUTLIER -89.37 -171.08 3.09 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.913 0.387 . . . . 0.0 111.3 -179.686 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.61 55.18 3.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.4 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.798 ' OG ' HG23 ' B' ' 14' ' ' ILE . 0.6 OUTLIER -117.57 -47.68 2.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.953 0.406 . . . . 0.0 110.412 179.377 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.755 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -135.37 -81.55 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.423 179.289 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 91' ' ' PHE . 7.2 m . . . . . 0 CA--C 1.531 0.239 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.672 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 121.342 0.592 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -41.76 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.953 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.903 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -68.0 -38.71 82.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.029 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.672 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.31 -33.56 29.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.469 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.59 -27.17 41.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.519 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.4 p -69.08 -45.1 71.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.211 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -66.09 -56.31 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.404 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.24 -27.21 13.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.679 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.3 OUTLIER -69.9 -55.56 9.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.32 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.907 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -68.51 -27.25 65.95 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.3 mt -69.42 -35.47 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-O 121.217 0.532 . . . . 0.0 110.832 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.38 51.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.408 -1.269 . . . . 0.0 112.613 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.907 HG22 ' O ' ' B' ' 13' ' ' LEU . 29.3 m -63.46 -37.2 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 109.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -80.48 -60.02 2.48 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.881 -178.605 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.915 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.1 OUTLIER -58.19 -26.75 63.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.465 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.28 -52.08 48.29 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.737 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.641 ' HB3' HD11 ' B' ' 30' ' ' LEU . 2.8 m-85 -80.64 -29.8 36.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.656 0.741 . . . . 0.0 109.215 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.915 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -83.3 20.13 1.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.172 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.533 179.885 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 120.969 0.414 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 5.8 p -146.19 158.75 43.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.034 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.762 HD12 ' CD2' ' B' ' 35' ' ' PHE . 0.0 OUTLIER -117.43 -156.14 0.62 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.88 179.598 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.511 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -137.89 136.41 37.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.947 0.403 . . . . 0.0 110.545 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.501 ' O ' HD23 ' B' ' 36' ' ' LEU . 21.5 mtmt -49.87 -39.75 40.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.673 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.646 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.29 -44.67 51.75 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.27 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.441 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 1.3 tt0 -59.88 -28.98 68.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.223 0.535 . . . . 0.0 109.987 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.762 ' CD2' HD12 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -75.6 -26.61 57.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.58 179.415 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' B' ' 33' ' ' THR . 2.4 mm? -51.49 -59.21 4.51 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.709 0.766 . . . . 0.0 110.571 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.17 69.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.422 -1.263 . . . . 0.0 110.407 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.466 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 12.6 t80 -57.92 -28.86 64.65 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.389 179.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.464 ' CE ' HD12 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -78.14 -35.84 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.942 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.768 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 59.8 m-80 -73.26 -19.79 60.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.178 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.81 -78.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 111.602 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.466 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 1.9 mm-40 -51.34 -28.39 12.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.082 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' A' ' 10' ' ' ILE . 38.7 mt -134.64 51.56 2.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.033 0.444 . . . . 0.0 110.482 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.768 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.83 -25.35 53.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.932 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.78 -14.52 63.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.174 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.45 -21.5 15.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.2 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.412 -179.645 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.717 HG22 ' O ' ' B' ' 86' ' ' ALA . 22.6 t . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.893 0.377 . . . . 0.0 111.391 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -50.97 70.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.85 -30.91 62.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.347 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -42.79 92.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.866 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.4 OUTLIER -63.48 -53.51 51.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.32 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.52 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.299 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.509 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 3.9 mm100 . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.766 0.317 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.609 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.4 OUTLIER -65.83 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 172.01 -164.89 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.574 0.625 . . . . 0.0 111.613 179.512 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.91 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.4 p90 -81.73 -57.16 3.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.384 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.514 HE22 ' HB3' ' B' ' 77' ' ' LEU . 7.6 tp-100 -80.38 -27.8 38.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.348 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.811 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -44.94 -36.52 3.41 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CD2' HG23 ' B' ' 16' ' ' VAL . 2.0 t80 -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.077 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.5 mt -50.17 -34.53 22.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -38.58 53.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.811 HD13 ' O ' ' B' ' 75' ' ' GLU . 1.8 mp -63.77 -58.24 7.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.713 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.905 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.66 -42.33 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.15 178.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.68 -50.04 50.83 Favored Glycine 0 CA--C 1.507 -0.461 0 N-CA-C 109.989 -1.245 . . . . 0.0 109.989 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.594 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.38 -40.39 45.95 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.403 -0.903 . . . . 0.0 111.446 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.866 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.1 mt -60.17 -45.63 92.45 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.332 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.585 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.36 -30.8 61.01 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.281 0.562 . . . . 0.0 110.891 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.916 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.04 -17.34 9.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.227 -179.639 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.717 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.35 12.79 17.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.194 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.16 -37.24 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.459 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.1 OUTLIER -89.3 -171.07 3.1 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.838 0.351 . . . . 0.0 111.356 -179.727 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.57 55.16 3.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.447 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.805 ' OG ' HG23 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -117.6 -47.59 2.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.406 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -135.43 -81.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.412 179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.571 HG22 ' O ' ' B' ' 91' ' ' PHE . 7.2 m . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.576 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 121.389 0.614 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.8 -49.23 10.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.442 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.812 HG23 ' CG1' ' B' ' 16' ' ' VAL . 3.9 m -64.12 -32.44 74.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.482 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.576 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.65 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.34 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' O ' ' OG ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -74.79 -26.86 60.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.372 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.566 ' HB3' HD22 ' B' ' 13' ' ' LEU . 73.7 m -68.14 -53.9 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.511 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.129 HG22 HD11 ' A' ' 14' ' ' ILE . 1.8 mp -50.77 -56.36 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.837 0.351 . . . . 0.0 111.355 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.822 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -53.88 -27.78 32.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.886 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -61.8 -55.61 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.268 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.047 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.75 55.93 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.129 HD11 HG22 ' A' ' 10' ' ' ILE . 5.3 mt -49.79 -29.29 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.103 0.478 . . . . 0.0 112.18 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.3 -31.75 21.43 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.842 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.047 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.6 m -53.32 -33.71 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.759 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.8 -56.44 4.13 Favored 'General case' 0 N--CA 1.46 0.06 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.79 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 8.6 mm-40 -48.54 -26.05 2.0 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.461 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.71 69.12 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.627 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -80.37 -50.4 10.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.947 0.879 . . . . 0.0 109.805 178.533 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.616 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -61.58 -52.14 65.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.929 -1.487 . . . . 0.0 112.167 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.457 179.959 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.76 HG12 ' O ' ' B' ' 90' ' ' SER . 29.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.785 0.326 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.616 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 p -149.22 -177.58 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.975 0.417 . . . . 0.0 111.15 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.627 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -141.55 -124.95 0.1 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.117 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.599 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -171.44 128.48 0.68 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.536 ' HG2' ' HE1' ' A' ' 60' ' ' MET . 19.6 mtmm -49.64 -41.17 41.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.858 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.643 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.65 -41.68 59.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.164 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.6 mt-10 -55.74 -28.84 57.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -26.91 59.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.236 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -61.19 -59.15 5.77 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.488 0.661 . . . . 0.0 111.672 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.8 p -64.6 -51.16 64.15 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.611 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.556 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.7 m-85 -58.05 -50.88 71.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.979 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.798 ' HG2' HG21 ' A' ' 47' ' ' THR . 3.3 ttm -58.62 -26.98 64.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.747 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 13.3 m-20 -73.25 -19.46 61.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.73 -79.96 0.59 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.511 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.66 -46.22 63.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.234 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.721 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -111.21 38.46 2.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.0 110.318 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.747 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.1 -30.32 58.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.774 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.28 -25.15 13.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.987 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.5 m-85 -109.39 23.65 14.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.011 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.798 HG21 ' HG2' ' A' ' 39' ' ' MET . 4.2 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-O 120.87 0.367 . . . . 0.0 110.972 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.458 HG12 HD22 ' A' ' 83' ' ' LEU . 95.7 t . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.694 0.283 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.856 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -67.37 -52.29 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.163 0.506 . . . . 0.0 110.663 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.856 ' N ' HD23 ' A' ' 56' ' ' LEU . 3.8 t0 -59.07 -26.8 64.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.678 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.85 -43.26 93.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.05 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.917 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -60.87 -53.29 59.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.892 0.377 . . . . 0.0 111.522 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.805 ' N ' ' HG2' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.031 -177.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.473 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 7.6 mm100 . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.575 0.226 . . . . 0.0 111.021 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.702 HD12 ' HD1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -61.32 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 9.4 t70 166.72 159.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.941 0.791 . . . . 0.0 111.226 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.786 ' CG ' HG11 ' B' ' 85' ' ' VAL . 27.8 p90 -50.22 -58.65 5.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.519 -0.764 . . . . 0.0 113.004 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.5 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 7.2 tp-100 -76.94 -29.29 55.57 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.278 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.736 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.97 -49.19 11.32 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.702 ' HD1' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -64.95 -54.91 23.12 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.621 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HG ' ' CZ ' ' A' ' 17' ' ' PHE . 5.7 mt -53.88 -33.98 58.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.2 0.524 . . . . 0.0 110.019 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -31.67 58.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.794 HD13 ' CG ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -70.36 -57.95 4.28 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.896 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.082 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.17 -42.8 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 CA-C-O 120.721 0.296 . . . . 0.0 110.434 178.424 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.74 -50.7 48.51 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.204 -0.998 . . . . 0.0 110.736 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -52.66 -36.7 49.28 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.768 178.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.917 HD21 ' HE3' ' A' ' 59' ' ' MET . 7.1 mt -63.64 -45.79 88.59 Favored 'General case' 0 CA--C 1.518 -0.27 0 O-C-N 122.692 -0.299 . . . . 0.0 110.452 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 88' ' ' HIS . . . -54.97 -32.02 61.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.32 0.581 . . . . 0.0 110.413 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.785 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.45 -17.58 9.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.347 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.84 13.66 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.379 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 1.7 t -154.4 -42.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 -179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.676 ' ND1' HD13 ' B' ' 14' ' ' ILE . 32.5 t-80 -87.67 150.19 23.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.927 0.394 . . . . 0.0 110.712 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.69 110.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.215 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.757 ' O ' HG12 ' B' ' 28' ' ' VAL . 1.3 m -178.94 -62.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.7 m-85 -115.11 -32.85 5.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.157 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.593 -179.52 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.568 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.436 0.636 . . . . 0.0 110.974 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.79 -49.22 10.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.395 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.832 HG23 ' CG1' ' A' ' 16' ' ' VAL . 4.0 m -64.14 -32.51 74.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.414 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.568 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.57 61.53 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.815 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' B' ' 12' ' ' SER . 0.0 OUTLIER -74.78 -26.84 60.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.44 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.57 ' HB3' HD22 ' A' ' 13' ' ' LEU . 73.7 m -68.17 -53.9 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.508 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.082 HG12 HD11 ' A' ' 80' ' ' ILE . 1.8 mp -50.71 -56.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.889 0.376 . . . . 0.0 111.339 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.9 OUTLIER -53.91 -27.73 32.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.864 -179.338 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.452 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.9 OUTLIER -61.9 -55.59 28.12 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 1.052 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.77 55.86 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.047 HD11 HG22 ' B' ' 10' ' ' ILE . 5.2 mt -49.65 -29.4 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 CA-C-O 121.09 0.471 . . . . 0.0 112.162 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.2 -31.86 21.52 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.827 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 1.052 HG22 ' O ' ' B' ' 13' ' ' LEU . 15.6 m -53.23 -33.86 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 177.108 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.747 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.74 -56.48 4.11 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.809 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.855 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 8.7 mm-40 -48.49 -26.12 2.0 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.442 -179.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -50.72 69.21 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.623 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -80.35 -50.38 10.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.919 0.866 . . . . 0.0 109.859 178.481 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -61.6 -52.11 65.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.888 -1.506 . . . . 0.0 112.173 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.44 179.977 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.757 HG12 ' O ' ' A' ' 90' ' ' SER . 29.9 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.737 0.303 . . . . 0.0 111.285 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 8.1 p -149.2 -177.59 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.958 0.409 . . . . 0.0 111.119 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.623 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -141.49 -124.96 0.1 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.129 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.603 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -171.45 128.6 0.68 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.534 ' HG2' ' HE1' ' B' ' 60' ' ' MET . 19.6 mtmm -49.68 -41.18 42.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.64 -41.73 59.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.153 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.6 mt-10 -55.75 -28.8 57.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 0.0 110.376 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.36 -26.82 58.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.171 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.2 mm? -61.22 -59.16 5.75 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.568 0.699 . . . . 0.0 111.717 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 46.6 p -64.49 -51.15 64.43 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.694 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.555 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.8 m-85 -58.09 -50.87 71.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.99 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.771 ' HG2' HG21 ' B' ' 47' ' ' THR . 3.3 ttm -58.64 -27.06 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 110.5 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.74 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 13.6 m-20 -73.16 -19.39 61.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.77 -79.92 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.567 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.62 -46.33 63.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.13 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.719 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -111.2 38.49 2.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.272 0.558 . . . . 0.0 110.292 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.74 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.11 -30.27 58.18 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.826 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.29 -25.19 13.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.5 m-85 -109.44 23.76 14.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.006 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.771 HG21 ' HG2' ' B' ' 39' ' ' MET . 4.2 t . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.469 HG12 HD22 ' B' ' 83' ' ' LEU . 94.3 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.711 0.291 . . . . 0.0 111.286 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.849 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -67.35 -52.31 41.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.126 0.489 . . . . 0.0 110.654 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.849 ' N ' HD23 ' B' ' 56' ' ' LEU . 3.8 t0 -59.01 -26.95 64.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.667 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.7 -43.23 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.051 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.991 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -60.94 -53.35 58.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 111.455 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.795 ' N ' ' HG2' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.017 -177.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.481 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 7.6 mm100 . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.54 0.21 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.737 HD12 ' HD1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -61.28 -129.62 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 9.4 t70 166.76 159.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.785 ' CG ' HG11 ' A' ' 85' ' ' VAL . 27.5 p90 -50.2 -58.71 5.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.951 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.49 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 7.1 tp-100 -76.95 -29.22 55.5 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.326 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.722 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.92 -49.2 11.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.737 ' HD1' HD12 ' B' ' 71' ' ' LEU . 0.1 OUTLIER -65.01 -54.85 23.86 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.616 179.281 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.485 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 5.6 mt -53.88 -34.0 58.15 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 110.031 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.423 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.0 OUTLIER -76.06 -31.71 58.94 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 177.84 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.8 HD13 ' CG ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -70.3 -57.92 4.33 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.977 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 1.006 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.18 -42.83 58.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 120.713 0.292 . . . . 0.0 110.38 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.63 49.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.167 -1.016 . . . . 0.0 110.758 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.481 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -52.73 -36.63 49.68 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.719 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.991 HD21 ' HE3' ' B' ' 59' ' ' MET . 7.1 mt -63.64 -45.9 88.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 O-C-N 122.698 -0.295 . . . . 0.0 110.449 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' B' ' 88' ' ' HIS . . . -54.97 -32.0 61.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.295 0.569 . . . . 0.0 110.429 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.786 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.63 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.443 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.81 13.67 17.24 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.307 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.433 ' N ' ' O ' ' B' ' 83' ' ' LEU . 1.7 t -154.4 -42.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.688 ' ND1' HD13 ' A' ' 14' ' ' ILE . 32.5 t-80 -87.67 150.08 23.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.822 0.344 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.65 110.61 0.53 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.23 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.76 ' O ' HG12 ' A' ' 28' ' ' VAL . 1.3 m -178.94 -62.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.7 m-85 -115.15 -32.8 5.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.057 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.501 -179.427 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.677 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.394 0.616 . . . . 0.0 111.23 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.49 -42.0 6.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.43 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.979 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -72.17 -41.74 66.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 109.998 179.188 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.677 ' HB2' HG23 ' A' ' 4' ' ' THR . 4.5 mm-40 -51.97 -45.85 64.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.984 0.421 . . . . 0.0 109.92 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -73.58 -26.62 60.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.584 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -64.55 -41.15 96.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.527 -179.507 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.979 HD12 ' O ' ' A' ' 6' ' ' THR . 3.4 mp -73.8 -51.31 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.955 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -51.83 -27.29 12.03 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.641 0.238 . . . . 0.0 111.641 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.578 ' O ' HG13 ' A' ' 16' ' ' VAL . 1.4 t -76.67 -55.73 5.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.653 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.48 65.16 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.955 HD12 ' HA ' ' A' ' 11' ' ' GLU . 20.1 mt -69.96 -41.53 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.865 0 CA-C-O 121.766 0.793 . . . . 0.0 110.741 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -73.99 -37.82 64.31 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.512 -175.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.847 HG22 ' O ' ' A' ' 13' ' ' LEU . 21.1 m -52.51 -36.99 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 121.731 0.777 . . . . 0.0 109.072 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.501 ' N ' HG23 ' A' ' 16' ' ' VAL . 2.9 t80 -80.52 -57.06 3.76 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 114.418 -1.265 . . . . 0.0 113.221 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.887 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.55 -24.48 62.8 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -52.16 64.19 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.415 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.629 ' OH ' HG21 ' A' ' 41' ' ' THR . 4.6 m-85 -80.51 -38.45 29.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.763 0.792 . . . . 0.0 109.473 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.887 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.16 -26.62 64.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.746 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.426 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.519 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.879 0.371 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 18.1 p -155.33 -178.34 7.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -136.82 -123.86 0.14 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.101 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.57 ' N ' HD22 ' A' ' 30' ' ' LEU . 5.3 t -175.68 130.33 0.26 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.65 -41.41 42.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.011 0.434 . . . . 0.0 110.474 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 0.9 OUTLIER -61.95 -50.35 72.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.313 179.317 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.432 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -57.8 -37.13 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -73.4 -31.03 63.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.272 178.319 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.76 -59.36 5.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.454 0.645 . . . . 0.0 110.217 179.112 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.703 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -61.18 -26.94 68.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.672 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.513 ' CD2' ' CE1' ' A' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.59 85.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.746 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.47 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 1.1 mtp -69.11 -35.23 76.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.133 0.492 . . . . 0.0 110.354 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.5 -19.24 60.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.879 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.809 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.3 t -110.38 -37.27 5.56 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.809 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.7 mm-40 -128.16 -27.01 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -176.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.707 HD21 HD11 ' B' ' 10' ' ' ILE . 5.1 mt -112.07 44.29 1.43 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.526 0.679 . . . . 0.0 109.718 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -78.68 -25.63 44.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.906 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.38 -23.41 65.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.444 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.573 ' CD1' HD22 ' A' ' 43' ' ' LEU . 3.9 m-85 -86.11 -32.33 21.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.542 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.9 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.177 -179.747 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.757 HG22 ' HB1' ' A' ' 86' ' ' ALA . 68.0 t . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 121.027 0.442 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.01 -51.69 10.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.099 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.85 -35.76 75.42 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.77 -52.3 66.3 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.656 ' HE1' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -75.34 -54.17 7.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.821 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.573 ' HE3' ' HA ' ' A' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.641 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 . . . . . 0 C--O 1.231 0.117 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.723 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -62.42 -133.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.492 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 4.6 t0 177.19 -178.95 0.19 Allowed 'General case' 0 N--CA 1.461 0.1 0 O-C-N 121.811 -0.556 . . . . 0.0 110.985 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CD2' HG21 ' B' ' 85' ' ' VAL . 44.1 p90 -69.22 -55.89 9.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.328 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.566 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -80.5 -26.3 38.26 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.74 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.723 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -44.62 -35.94 2.83 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.274 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.525 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 2.1 t80 -77.87 -54.01 6.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.638 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.801 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.2 mt -57.85 -33.4 68.61 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.566 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.04 -49.23 18.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.366 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 1.058 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 5.6 mp -65.62 -61.5 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.863 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.57 ' CG1' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.86 -44.58 86.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.574 178.72 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.805 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -60.77 -50.24 69.7 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 178.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.565 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -58.86 -39.77 94.34 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.053 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 1.058 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.8 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 88' ' ' HIS . . . -58.79 -41.45 86.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.544 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.835 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -74.22 -17.29 16.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.321 -179.139 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.757 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -109.34 17.59 21.33 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.329 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.44 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.586 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.457 ' N ' ' O ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.71 2.53 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.465 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.661 ' HG2' HG23 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -178.86 -168.84 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 111.248 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.11 -27.39 57.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.661 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -53.96 52.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.757 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.248 -179.874 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.702 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.282 0 CA-C-O 121.43 0.633 . . . . 0.0 111.223 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.44 -42.03 6.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.339 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.972 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -72.1 -41.85 66.81 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.002 0.429 . . . . 0.0 109.989 179.197 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.702 ' HB2' HG23 ' B' ' 4' ' ' THR . 4.5 mm-40 -51.86 -45.82 64.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.021 0.439 . . . . 0.0 109.931 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -73.59 -26.67 60.92 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.611 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -64.58 -41.03 96.54 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.597 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 0.972 HD12 ' O ' ' B' ' 6' ' ' THR . 3.4 mp -73.92 -51.32 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.839 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 1.012 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -51.88 -27.17 11.91 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.909 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.579 ' O ' HG13 ' B' ' 16' ' ' VAL . 1.4 t -76.78 -55.75 5.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.523 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.822 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.44 65.13 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.012 HD12 ' HA ' ' B' ' 11' ' ' GLU . 20.2 mt -69.94 -41.48 79.49 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.876 0 CA-C-O 121.878 0.847 . . . . 0.0 110.838 178.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' ALA . . . . . 0.486 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -74.05 -37.82 64.16 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 113.513 -1.676 . . . . 0.0 112.523 -175.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.822 HG22 ' O ' ' B' ' 13' ' ' LEU . 21.0 m -52.44 -36.97 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-O 121.718 0.77 . . . . 0.0 109.092 177.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.488 ' N ' HG23 ' B' ' 16' ' ' VAL . 2.9 t80 -80.44 -57.24 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.462 -1.245 . . . . 0.0 113.232 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.903 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.46 -24.49 62.89 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -177.456 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.17 64.2 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.378 -179.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.62 ' OH ' HG21 ' B' ' 41' ' ' THR . 4.6 m-85 -80.53 -38.44 29.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.796 0.808 . . . . 0.0 109.421 177.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.903 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.23 -26.57 65.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.746 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.565 -179.915 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.925 0.393 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.679 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 18.0 p -155.32 -178.37 7.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -136.78 -123.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.151 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.565 ' N ' HD22 ' B' ' 30' ' ' LEU . 5.3 t -175.66 130.28 0.26 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.675 0.274 . . . . 0.0 110.281 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -41.32 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 0.0 110.503 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 0.9 OUTLIER -62.07 -50.32 72.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.293 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 0.5 OUTLIER -57.85 -37.07 73.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.279 0.561 . . . . 0.0 109.6 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -73.38 -31.07 63.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.274 178.234 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.1 OUTLIER -58.79 -59.32 5.61 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.463 0.649 . . . . 0.0 110.226 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.694 ' O ' HG22 ' B' ' 41' ' ' THR . 0.3 OUTLIER -61.25 -26.9 68.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.659 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.503 ' CD2' ' CE1' ' B' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.53 85.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.748 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.556 ' HE3' ' HB3' ' B' ' 43' ' ' LEU . 1.1 mtp -69.2 -35.09 75.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.09 0.471 . . . . 0.0 110.369 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.56 -19.22 60.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.9 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.79 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.3 t -110.46 -37.19 5.56 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.79 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.7 mm-40 -128.21 -27.05 2.75 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.722 HD21 HD11 ' A' ' 10' ' ' ILE . 5.1 mt -111.97 44.2 1.44 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.415 0.626 . . . . 0.0 109.707 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -78.58 -25.68 45.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.948 -179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.34 -23.43 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.588 ' CD1' HD22 ' B' ' 43' ' ' LEU . 3.9 m-85 -86.05 -32.38 21.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.8 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.182 -179.807 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.761 HG22 ' HB1' ' B' ' 86' ' ' ALA . 67.3 t . . . . . 0 N--CA 1.455 -0.204 0 CA-C-O 120.976 0.417 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 5.5 tp -76.94 -51.84 10.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.093 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.74 -35.79 75.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.673 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.77 -52.36 66.04 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.661 ' HE1' ' O ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -75.33 -54.12 7.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.831 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.595 ' HE3' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.62 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 . . . . . 0 CA--C 1.528 0.113 0 CA-C-O 120.588 0.232 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.71 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -62.55 -133.86 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.465 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 4.5 t0 177.2 -179.0 0.19 Allowed 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.473 0.579 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.835 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.8 p90 -69.07 -56.01 9.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.384 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -80.45 -26.24 38.46 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.821 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.721 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.66 -35.92 2.85 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.342 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 2.1 t80 -77.8 -54.15 6.67 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.629 178.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.805 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.2 mt -57.72 -33.58 68.57 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.0 OUTLIER -75.84 -49.34 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 1.068 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 5.6 mp -65.63 -61.43 2.09 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.872 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.564 HD11 ' CG1' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -57.87 -44.54 86.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.585 178.746 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.801 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -60.78 -50.35 68.58 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.569 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -58.79 -39.68 94.07 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.189 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 1.068 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.81 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' B' ' 88' ' ' HIS . . . -58.78 -41.44 86.66 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.64 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.837 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -74.16 -17.39 16.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.404 -179.259 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.761 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -109.25 17.67 21.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.458 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.45 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.526 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.496 ' N ' ' O ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.74 2.53 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.439 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.63 ' HG2' HG23 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -178.88 -168.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.322 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.12 -27.33 57.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.649 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -53.89 53.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.269 -179.96 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.231 0 CA-C-O 121.397 0.618 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.9 -47.64 11.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.528 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.91 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.6 m -66.79 -34.77 78.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.628 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.638 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.59 -39.19 57.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.704 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.11 -26.67 60.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.965 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.624 ' HB3' HD22 ' B' ' 13' ' ' LEU . 76.3 m -69.8 -52.65 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.034 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -58.26 -56.65 14.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.923 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.56 -27.07 15.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.518 -179.627 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -64.39 -55.88 18.05 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.907 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.959 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -74.25 -27.28 60.68 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.034 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -66.73 -35.95 76.05 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 O-C-N 121.73 -0.606 . . . . 0.0 110.824 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.86 61.17 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.25 -176.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.959 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -53.84 -36.18 29.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.471 0.653 . . . . 0.0 109.74 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.529 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -80.17 -60.04 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.725 -178.742 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.987 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 3.6 pt20 -66.7 -28.64 68.6 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.11 -50.99 57.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.948 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -79.67 -31.84 41.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.583 0.706 . . . . 0.0 109.562 178.022 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -71.55 -6.99 44.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 114.737 -1.12 . . . . 0.0 112.003 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 C--N 1.331 0.254 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.501 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' A' ' 29' ' ' THR . 3.3 m . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.717 -0.182 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.655 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p 54.09 163.22 0.01 OUTLIER 'General case' 0 C--N 1.339 0.143 0 CA-C-O 121.26 0.553 . . . . 0.0 111.637 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -114.98 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.13 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.523 ' N ' HD22 ' A' ' 30' ' ' LEU . 14.0 t 175.33 130.03 0.03 OUTLIER 'General case' 0 C--O 1.231 0.113 0 O-C-N 122.21 -0.306 . . . . 0.0 110.387 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -32.38 32.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.987 0.422 . . . . 0.0 110.757 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.588 ' HA ' HD12 ' A' ' 36' ' ' LEU . 1.0 OUTLIER -68.15 -48.61 64.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.024 179.291 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -28.74 70.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -70.8 -33.36 70.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.6 178.498 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.77 -59.73 4.97 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.502 0.668 . . . . 0.0 111.137 179.881 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.0 m -59.54 -34.02 72.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.06 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CE1' ' CB ' ' A' ' 42' ' ' GLU . 72.8 t80 -60.07 -55.02 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.676 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -58.57 -28.93 66.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.81 -19.77 60.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.88 -80.95 0.63 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' CB ' ' CE1' ' A' ' 38' ' ' PHE . 2.3 mm-40 -55.59 -24.31 32.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.46 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.957 HD21 HD11 ' B' ' 10' ' ' ILE . 11.4 mt -135.04 48.76 2.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.024 0.44 . . . . 0.0 110.838 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.41 -28.15 62.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.325 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.85 -24.75 62.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.636 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.623 ' HD2' HD22 ' A' ' 43' ' ' LEU . 66.8 m-85 -102.26 26.9 7.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.567 HG21 ' HG2' ' A' ' 39' ' ' MET . 5.0 t . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.773 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.663 HG12 HD22 ' A' ' 83' ' ' LEU . 94.2 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.91 0.386 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.713 HD12 ' SD ' ' A' ' 39' ' ' MET . 5.5 tt -68.46 -52.62 30.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.433 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.442 ' N ' HD23 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -58.02 -33.4 68.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.212 -178.772 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -54.18 50.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.251 . . . . 0.0 111.56 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -76.48 -42.56 43.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.439 ' HG3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.504 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 2.4 mm100 . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.745 0.307 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.531 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.26 -130.22 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 119.119 -0.467 . . . . 0.0 109.888 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.531 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.5 t0 175.31 -173.98 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.324 0.965 . . . . 0.0 112.375 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.849 ' CD2' HG21 ' B' ' 85' ' ' VAL . 43.5 p90 -83.2 -57.16 3.38 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.071 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.466 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 7.4 tp-100 -78.27 -30.76 48.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.422 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.862 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.61 -48.27 10.41 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.529 ' CB ' ' HB2' ' A' ' 17' ' ' PHE . 1.7 t80 -65.21 -52.95 51.49 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.298 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.425 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.1 mt -53.2 -38.96 63.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.145 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -36.61 58.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.862 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -61.5 -57.23 12.97 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.841 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.982 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.21 -44.8 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.802 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.468 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -52.75 -50.7 48.58 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -56.56 -31.26 60.07 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.225 -0.988 . . . . 0.0 111.525 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.834 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 16.6 mt -66.54 -44.77 81.49 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.73 -33.86 64.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.272 0.558 . . . . 0.0 110.776 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.855 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.96 9.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.736 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.62 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -115.13 14.31 16.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.189 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.63 -40.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.399 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.507 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.7 t-160 -93.4 177.99 5.86 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.876 0.37 . . . . 0.0 111.123 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.54 93.55 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.55 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 173.92 111.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.566 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.1 t80 68.69 -67.06 0.22 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.714 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.1 179.851 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.632 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 121.414 0.626 . . . . 0.0 110.855 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -47.6 11.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.606 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.6 m -66.72 -34.79 78.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.678 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.632 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.56 -39.23 57.4 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.69 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.03 -26.74 60.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.983 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.627 ' HB3' HD22 ' A' ' 13' ' ' LEU . 78.5 m -69.87 -52.59 23.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.175 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.062 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -58.27 -56.68 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.764 0.316 . . . . 0.0 111.414 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.927 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.55 -27.07 15.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.452 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -64.41 -55.93 17.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.875 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.957 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -74.11 -27.34 60.83 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.062 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -66.77 -35.97 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-O 121.387 0.613 . . . . 0.0 110.785 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.8 61.19 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.228 -1.351 . . . . 0.0 112.331 -176.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.957 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.0 m -53.88 -36.12 29.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.467 0.651 . . . . 0.0 109.714 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.528 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -80.19 -60.11 2.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.865 -1.062 . . . . 0.0 112.654 -178.668 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.992 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 3.7 pt20 -66.74 -28.58 68.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.06 -50.93 57.72 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.48 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -79.74 -31.81 41.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 109.606 177.981 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.992 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -71.52 -6.98 44.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.009 -179.538 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.545 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' B' ' 29' ' ' THR . 3.4 m . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.652 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p 53.93 163.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.126 0 CA-C-O 121.228 0.537 . . . . 0.0 111.676 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.61 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -115.04 0.31 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.108 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.527 ' N ' HD22 ' B' ' 30' ' ' LEU . 13.8 t 175.43 130.17 0.04 OUTLIER 'General case' 0 C--O 1.231 0.126 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.98 -32.33 33.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.762 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.595 ' HA ' HD12 ' B' ' 36' ' ' LEU . 1.0 OUTLIER -68.22 -48.58 64.76 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.952 179.335 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -28.65 70.02 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.522 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -70.84 -33.41 70.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.512 178.504 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.595 HD12 ' HA ' ' B' ' 33' ' ' THR . 0.2 OUTLIER -58.74 -59.72 4.96 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.431 0.634 . . . . 0.0 111.109 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -59.52 -34.03 72.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.086 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.446 ' CE1' ' CB ' ' B' ' 42' ' ' GLU . 73.1 t80 -60.09 -55.06 38.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.609 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.716 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.3 OUTLIER -58.61 -28.85 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.86 -19.72 60.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.821 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.95 -81.02 0.63 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.446 ' CB ' ' CE1' ' B' ' 38' ' ' PHE . 2.3 mm-40 -55.56 -24.24 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.496 -178.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.928 HD21 HD11 ' A' ' 10' ' ' ILE . 11.3 mt -135.11 48.79 2.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.794 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -27.99 62.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.367 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.7 62.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.722 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.609 ' HD2' HD22 ' B' ' 43' ' ' LEU . 67.0 m-85 -102.24 26.72 7.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.873 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.595 HG21 ' HG2' ' B' ' 39' ' ' MET . 5.0 t . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.768 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.648 HG12 HD22 ' B' ' 83' ' ' LEU . 94.6 t . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.716 HD12 ' SD ' ' B' ' 39' ' ' MET . 5.5 tt -68.59 -52.5 31.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.455 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.438 ' N ' HD23 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -58.09 -33.35 68.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.147 -178.824 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -54.22 49.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.644 0.259 . . . . 0.0 111.502 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -76.44 -42.63 43.35 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.431 ' HG3' HD12 ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 2.4 mm100 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.715 0.293 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.53 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -65.2 -130.26 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.53 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 1.5 t0 175.28 -174.06 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.232 0.924 . . . . 0.0 112.256 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.855 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.3 p90 -83.19 -57.07 3.43 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.095 -179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.456 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 7.4 tp-100 -78.27 -30.8 48.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.444 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.859 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.63 -48.14 10.46 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.528 ' CB ' ' HB2' ' B' ' 17' ' ' PHE . 1.7 t80 -65.32 -52.86 51.21 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.32 178.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.1 mt -53.3 -38.93 63.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.964 0.411 . . . . 0.0 110.147 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -36.81 58.27 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.859 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -61.27 -57.35 12.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.891 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.1 -44.92 30.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 123.639 0.587 . . . . 0.0 110.76 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.487 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.66 -50.77 47.7 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.521 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -56.66 -31.17 60.26 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 120.197 -1.002 . . . . 0.0 111.505 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.833 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 16.8 mt -66.63 -44.73 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.65 -33.94 64.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.237 0.541 . . . . 0.0 110.787 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.849 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.95 9.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.793 -179.442 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.612 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -115.14 14.47 17.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.226 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.64 -40.5 0.05 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.443 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.8 t-160 -93.44 178.0 5.85 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 120.94 0.4 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.71 93.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.273 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.551 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 173.93 111.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.606 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.546 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.1 t80 68.67 -67.02 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.823 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.131 179.791 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.338 0.589 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.03 10.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.101 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.992 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.52 -41.59 92.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.07 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.13 -35.72 36.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.498 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.67 -27.13 40.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.75 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.603 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.5 p -70.45 -41.37 72.93 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.296 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' A' ' 14' ' ' ILE . 2.9 mp -69.3 -54.95 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.731 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.994 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -51.84 -27.22 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.376 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 6.1 m -75.25 -55.83 5.32 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.84 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' B' ' 13' ' ' LEU . 3.9 mm? -61.13 -27.34 68.32 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' A' ' 10' ' ' ILE . 9.3 mt -71.8 -37.4 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 CA-C-O 121.505 0.669 . . . . 0.0 110.332 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.54 64.03 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.875 -177.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.838 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.4 m -53.8 -35.7 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.48 0.657 . . . . 0.0 109.479 178.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.491 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -80.33 -59.74 2.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.582 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.942 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 5.1 pt20 -69.91 -24.97 63.47 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -51.71 57.92 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.244 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.9 m-85 -80.19 -40.22 27.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.712 0.768 . . . . 0.0 109.41 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.942 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.85 -26.16 57.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.707 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.712 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 p . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.812 0.339 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.654 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.1 p -129.98 -176.87 4.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.753 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.657 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -137.81 -122.96 0.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.524 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.634 ' N ' HD22 ' A' ' 30' ' ' LEU . 18.5 t -179.82 127.9 0.09 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 36' ' ' LEU . 0.0 OUTLIER -49.77 -40.69 42.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.18 -179.095 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.63 ' HA ' HD13 ' A' ' 36' ' ' LEU . 5.0 t -61.86 -43.51 98.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.459 ' N ' HG23 ' A' ' 33' ' ' THR . 15.7 mt-10 -61.52 -35.75 78.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.89 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -74.2 -29.9 61.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 176.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.84 -59.36 5.35 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.873 178.914 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -63.55 -41.19 98.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.489 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 t80 -60.02 -45.22 93.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.406 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.435 ' HE2' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -62.46 -31.28 71.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.788 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 18.7 m-80 -73.52 -19.74 60.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.39 -79.34 0.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.091 0.472 . . . . 0.0 111.862 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 2.7 mt-10 -52.07 -29.04 19.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.224 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' B' ' 10' ' ' ILE . 52.6 mt -130.41 50.14 2.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.099 0.476 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -79.2 -28.45 42.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.779 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.63 67.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.137 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.47 ' HD2' HD22 ' A' ' 43' ' ' LEU . 39.3 m-85 -102.06 27.2 6.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.962 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 65.0 p . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.202 -179.935 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 86' ' ' ALA . 39.0 t . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 59' ' ' MET . 7.7 tp -67.67 -51.16 53.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.96 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.84 -27.0 49.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -50.52 71.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.053 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.911 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.4 ptp -57.07 -53.52 57.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.277 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.503 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.364 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.49 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 7.4 mm-40 . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.779 0.323 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.492 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -65.29 -131.38 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.932 179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.69 -168.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.879 0.763 . . . . 0.0 111.364 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.885 ' CG ' HG11 ' B' ' 85' ' ' VAL . 39.8 p90 -80.84 -60.51 2.28 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.894 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.464 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.1 -22.19 42.46 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.225 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.781 ' O ' HD13 ' A' ' 79' ' ' LEU . 2.1 tt0 -47.17 -32.66 4.55 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.381 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.531 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.3 t80 -80.51 -54.31 5.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.722 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' B' ' 77' ' ' LEU . 5.8 mt -53.75 -33.97 57.48 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.43 -40.71 49.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 177.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.7 mp -62.39 -57.64 10.55 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.03 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.891 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -75.21 -45.27 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.121 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.559 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.44 -48.87 53.87 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.47 -41.44 48.84 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.255 -0.974 . . . . 0.0 111.318 178.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.911 HD21 ' HE2' ' A' ' 59' ' ' MET . 9.1 mt -56.72 -47.65 79.49 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 110.661 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.62 -32.61 63.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.184 0.516 . . . . 0.0 111.27 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.27 -17.57 9.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.607 -179.411 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.652 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -112.5 2.21 16.22 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.368 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.492 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -137.6 -41.48 0.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 -179.934 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' B' ' 14' ' ' ILE . 0.7 OUTLIER -82.09 -166.64 1.29 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.887 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.87 36.4 1.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.312 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.618 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -99.53 7.56 45.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.779 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 177.92 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.386 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.1 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.857 179.897 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.246 0.546 . . . . 0.0 111.242 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.06 10.61 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.074 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.995 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.44 -41.62 93.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.192 0.52 . . . . 0.0 110.108 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.14 -35.71 37.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.539 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -27.25 41.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.803 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.618 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.5 p -70.33 -41.42 73.24 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.322 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.06 HG22 HD11 ' B' ' 14' ' ' ILE . 2.9 mp -69.32 -54.99 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.707 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -51.75 -27.29 11.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.336 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.559 ' O ' HG13 ' B' ' 16' ' ' VAL . 6.2 m -75.25 -55.92 5.23 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.764 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' A' ' 13' ' ' LEU . 3.9 mm? -61.03 -27.29 68.22 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.06 HD11 HG22 ' B' ' 10' ' ' ILE . 9.3 mt -71.86 -37.42 61.63 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 121.478 0.656 . . . . 0.0 110.336 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 -39.57 64.12 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.917 -177.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.827 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.4 m -53.76 -35.7 27.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.487 0.661 . . . . 0.0 109.479 178.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.487 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -80.28 -59.78 2.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.617 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.94 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 5.1 pt20 -69.92 -24.92 63.45 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -178.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -51.79 57.14 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.258 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.528 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.9 m-85 -80.2 -40.1 27.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.68 0.752 . . . . 0.0 109.413 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.94 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -57.01 -26.09 59.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.675 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.718 -179.753 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.749 0.309 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.664 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.1 p -130.05 -176.86 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -137.8 -122.92 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.539 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.635 ' N ' HD22 ' B' ' 30' ' ' LEU . 18.8 t -179.88 127.84 0.08 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' B' ' 36' ' ' LEU . 0.0 OUTLIER -49.58 -40.68 39.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.239 -179.149 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.626 ' HA ' HD13 ' B' ' 36' ' ' LEU . 5.0 t -61.99 -43.44 98.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.464 ' N ' HG23 ' B' ' 33' ' ' THR . 15.7 mt-10 -61.5 -35.65 78.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.896 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -74.32 -29.85 61.79 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 176.962 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.626 HD13 ' HA ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -57.81 -59.39 5.3 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.874 178.944 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.9 p -63.6 -41.16 98.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.411 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 9.0 t80 -60.08 -45.19 93.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.429 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.422 ' HE2' HD13 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -62.39 -31.39 72.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.824 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 18.9 m-80 -73.4 -19.72 60.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.242 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.45 -79.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.102 0.477 . . . . 0.0 111.777 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.7 mt-10 -52.02 -29.04 19.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.224 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.758 HD21 HD11 ' A' ' 10' ' ' ILE . 53.6 mt -130.33 50.09 2.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.039 0.447 . . . . 0.0 110.811 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -79.22 -28.41 42.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.01 -24.71 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.072 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.495 ' HD2' HD22 ' B' ' 43' ' ' LEU . 39.0 m-85 -102.08 27.26 6.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.96 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 65.4 p . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.177 -179.918 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 86' ' ' ALA . 39.0 t . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 121.019 0.438 . . . . 0.0 111.094 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.453 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -67.74 -51.09 53.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.997 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -55.83 -26.96 49.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.32 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -50.42 72.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.008 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.933 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.4 ptp -57.13 -53.48 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.293 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.506 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.399 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.483 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 7.4 mm-40 . . . . . 0 N--CA 1.454 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.913 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.497 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.3 OUTLIER -65.35 -131.4 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.931 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.446 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.2 OUTLIER 172.68 -168.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.939 0.791 . . . . 0.0 111.392 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CG ' HG11 ' A' ' 85' ' ' VAL . 39.9 p90 -80.92 -60.6 2.24 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.761 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.03 -22.25 42.6 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.21 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.1 tt0 -47.19 -32.66 4.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 178.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.2 t80 -80.48 -54.28 5.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.765 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' A' ' 77' ' ' LEU . 5.8 mt -53.79 -33.88 57.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.44 -40.73 49.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.896 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.7 mp -62.24 -57.67 10.59 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.07 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.91 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -75.24 -45.32 41.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.073 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.567 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.5 -48.86 54.28 Favored Glycine 0 C--N 1.333 0.4 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.508 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.43 -41.36 48.38 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.359 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.933 HD21 ' HE2' ' B' ' 59' ' ' MET . 9.2 mt -56.93 -47.55 80.37 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 120.676 0.274 . . . . 0.0 110.623 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.47 -32.81 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.199 0.523 . . . . 0.0 111.254 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.885 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.51 9.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.592 -179.332 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.638 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -112.48 2.17 16.22 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.418 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -137.59 -41.49 0.55 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' A' ' 14' ' ' ILE . 0.7 OUTLIER -82.06 -166.65 1.29 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.815 0.34 . . . . 0.0 110.919 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.76 36.35 1.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.346 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.619 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.0 OUTLIER -99.56 7.53 45.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.051 179.744 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.793 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 177.88 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 t . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.799 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 121.544 0.688 . . . . 0.0 111.152 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.36 -48.98 13.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.417 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.952 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.3 m -64.34 -37.1 86.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.53 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.75 -38.25 54.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.727 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.87 -26.77 43.99 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.092 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HB3' HD22 ' B' ' 13' ' ' LEU . 63.9 m -69.23 -52.99 22.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.139 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -53.25 -56.15 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.541 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.44 -27.31 15.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.656 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.601 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -68.52 -55.9 10.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.805 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.96 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -68.68 -27.69 66.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -178.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.139 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -68.1 -36.34 75.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 O-C-N 121.666 -0.646 . . . . 0.0 110.508 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -32.65 41.89 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.482 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.2 m -51.73 -37.14 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.473 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.9 t80 -78.37 -58.54 3.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.319 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.788 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.5 mm-40 -49.13 -32.92 10.85 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.23 -51.96 67.59 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.876 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.1 m-85 -81.2 -47.69 13.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.778 0.799 . . . . 0.0 109.963 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.438 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -61.31 -17.03 51.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.887 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.39 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.491 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 28' ' ' VAL . 14.3 p . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -143.38 150.84 39.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.144 0.497 . . . . 0.0 111.455 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -107.69 -152.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.961 179.264 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.451 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -148.52 147.62 29.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.207 0.527 . . . . 0.0 111.089 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -44.76 68.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.755 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.056 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -74.62 -36.4 62.93 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.33 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -55.06 -30.63 60.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.391 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.514 ' CE2' ' HB3' ' A' ' 79' ' ' LEU . 2.3 t80 -81.21 -47.55 13.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.272 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 1.056 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -63.46 -28.08 69.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.783 0.325 . . . . 0.0 110.39 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.57 -28.38 33.86 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 20' ' ' TYR . 3.4 t80 -59.06 -54.79 43.09 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.983 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.568 ' HE2' ' HB3' ' A' ' 43' ' ' LEU . 2.8 mtp -48.8 -30.11 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.521 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -73.59 -19.47 60.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.186 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -105.11 -50.8 3.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.309 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.569 ' O ' HG21 ' B' ' 4' ' ' THR . 1.1 mm-40 -128.31 -12.55 5.07 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -177.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.945 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -117.48 46.71 1.66 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.353 0.597 . . . . 0.0 110.296 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.11 -30.54 27.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.993 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.43 -26.02 28.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.823 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -97.23 22.72 8.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.56 HG21 ' HB3' ' A' ' 39' ' ' MET . 26.2 p . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.686 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 121.169 0.509 . . . . 0.0 110.53 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.48 ' N ' HG22 ' A' ' 55' ' ' VAL . 8.7 tp -68.99 -51.48 38.96 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.002 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.16 -28.72 69.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.212 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.61 73.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.821 0.344 . . . . 0.0 110.849 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE3' HD21 ' A' ' 83' ' ' LEU . 1.8 ptp -67.27 -53.44 29.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.138 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.736 ' HE2' ' HG3' ' A' ' 59' ' ' MET . 10.0 mmt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.31 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.537 ' O ' ' O ' ' A' ' 71' ' ' LEU . 5.4 mm100 . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 120.389 0.138 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.661 HD11 HD22 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -54.2 -130.62 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.571 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.596 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 3.8 p30 162.4 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.841 ' CG ' HG11 ' B' ' 85' ' ' VAL . 41.6 p90 -83.39 -58.62 2.75 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.54 ' O ' ' N ' ' A' ' 78' ' ' ASN . 7.6 tp-100 -80.33 -34.54 36.56 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' HG ' ' A' ' 71' ' ' LEU . 2.2 tt0 -44.49 -39.54 4.9 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.285 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.546 ' CD2' HD12 ' A' ' 30' ' ' LEU . 3.2 t80 -71.74 -52.86 15.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.749 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -55.62 -33.45 64.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -73.03 -40.3 65.25 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.928 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.667 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.8 mp -62.51 -57.13 12.26 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.543 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.074 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -70.45 -42.74 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 CA-C-O 120.828 0.347 . . . . 0.0 110.507 178.567 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.67 -50.58 48.57 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.413 -0.899 . . . . 0.0 110.895 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.74 -41.0 49.89 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.352 -0.927 . . . . 0.0 111.721 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE3' ' A' ' 59' ' ' MET . 4.0 mt -60.17 -46.79 88.51 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 122.634 -0.333 . . . . 0.0 110.787 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.13 58.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.093 0.473 . . . . 0.0 111.296 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.834 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.61 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.114 -178.8 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -117.66 8.46 12.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.963 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.82 -37.78 0.4 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.663 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.602 ' CD2' HD13 ' B' ' 14' ' ' ILE . 1.6 t60 -103.49 166.68 10.28 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.883 0.373 . . . . 0.0 111.06 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -59.75 115.7 3.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.64 -68.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.681 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.741 ' HB2' HG12 ' A' ' 85' ' ' VAL . 4.5 t80 -114.67 -32.56 5.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.749 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.472 -179.529 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.681 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.23 0 CA-C-O 121.51 0.671 . . . . 0.0 111.229 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.3 -49.08 12.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.323 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.961 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.4 m -64.32 -37.04 86.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.51 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.681 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -38.19 54.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.768 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.91 -26.82 43.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.061 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB3' HD22 ' A' ' 13' ' ' LEU . 63.9 m -69.21 -52.93 22.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.244 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.11 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -53.19 -56.18 9.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.639 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.948 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.28 -27.52 15.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.757 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.614 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -68.5 -55.86 10.32 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.697 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.958 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -68.67 -27.76 66.27 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.11 HD11 HG22 ' B' ' 10' ' ' ILE . 7.6 mt -68.08 -36.4 75.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 O-C-N 121.724 -0.61 . . . . 0.0 110.446 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.58 -32.56 42.0 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.545 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.958 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.9 m -51.77 -37.12 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.467 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.8 t80 -78.39 -58.62 3.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.3 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.5 mm-40 -49.06 -32.94 10.48 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.16 -51.93 67.66 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.959 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.667 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.1 m-85 -81.17 -47.74 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.782 0.801 . . . . 0.0 109.952 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.422 ' HB2' ' CE1' ' B' ' 17' ' ' PHE . . . -61.43 -16.92 51.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.926 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.421 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.603 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 28' ' ' VAL . 14.2 p . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.878 0.371 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -143.39 150.83 39.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.211 0.529 . . . . 0.0 111.508 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.667 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -107.71 -152.33 0.48 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.91 179.361 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.45 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -148.49 147.51 29.19 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.128 0.489 . . . . 0.0 111.115 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -44.81 68.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.751 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' THR . . . . . 1.004 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -74.61 -36.41 62.95 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.295 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.421 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -55.16 -30.59 60.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.521 ' CE2' ' HB3' ' B' ' 79' ' ' LEU . 2.3 t80 -81.28 -47.52 13.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.246 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 1.004 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.6 OUTLIER -63.42 -28.03 69.7 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 120.872 0.367 . . . . 0.0 110.509 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.55 -28.42 33.91 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.222 0.534 . . . . 0.0 109.641 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.498 ' CD2' ' CD1' ' B' ' 20' ' ' TYR . 3.4 t80 -58.95 -54.79 43.17 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.01 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.571 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 2.7 mtp -48.89 -30.17 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -73.55 -19.51 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' B' ' 38' ' ' PHE . 0.7 OUTLIER -105.08 -50.74 3.17 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -178.313 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.581 ' O ' HG21 ' A' ' 4' ' ' THR . 1.1 mm-40 -128.42 -12.5 5.01 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.991 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -117.63 46.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.294 0.568 . . . . 0.0 110.218 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.19 -30.53 27.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.989 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.39 -26.03 27.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -97.28 22.87 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.852 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.548 HG21 ' HB3' ' B' ' 39' ' ' MET . 26.6 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.178 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.703 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 121.136 0.493 . . . . 0.0 110.489 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.478 ' N ' HG22 ' B' ' 55' ' ' VAL . 8.7 tp -69.05 -51.47 38.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.96 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.14 -28.69 69.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -35.57 73.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' MET . . . . . 1.072 ' HE3' HD21 ' B' ' 83' ' ' LEU . 1.8 ptp -67.23 -53.41 30.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.723 ' HE2' ' HG3' ' B' ' 59' ' ' MET . 10.0 mmt . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.247 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.527 ' O ' ' O ' ' B' ' 71' ' ' LEU . 5.5 mm100 . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.391 0.139 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.664 HD11 HD22 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -54.3 -130.64 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.593 -179.685 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.598 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 3.7 p30 162.53 -148.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.834 ' CG ' HG11 ' A' ' 85' ' ' VAL . 41.7 p90 -83.38 -58.57 2.77 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.094 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.586 ' O ' ' N ' ' B' ' 78' ' ' ASN . 7.7 tp-100 -80.31 -34.59 36.65 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.615 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.2 tt0 -44.63 -39.39 4.99 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.296 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD2' HD12 ' B' ' 30' ' ' LEU . 3.2 t80 -71.72 -52.9 15.4 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.4 mt -55.56 -33.51 63.93 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -72.96 -40.35 65.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.897 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.681 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.8 mp -62.47 -57.22 12.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.472 179.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.989 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -70.43 -42.75 78.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.769 0.319 . . . . 0.0 110.497 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.67 -50.64 48.3 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.572 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.79 -40.95 50.17 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.37 -0.919 . . . . 0.0 111.725 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 1.072 HD21 ' HE3' ' B' ' 59' ' ' MET . 4.0 mt -60.09 -46.87 88.14 Favored 'General case' 0 C--N 1.332 -0.171 0 O-C-N 122.624 -0.339 . . . . 0.0 110.813 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.51 -29.1 58.25 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.089 0.471 . . . . 0.0 111.348 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.841 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.62 9.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.04 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -117.66 8.45 12.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.978 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.81 -37.81 0.4 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.655 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.61 ' CD2' HD13 ' A' ' 14' ' ' ILE . 1.6 t60 -103.5 166.61 10.32 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.922 0.391 . . . . 0.0 111.052 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.64 115.71 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.69 -68.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.703 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 4.5 t80 -114.58 -32.49 5.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.77 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.505 -179.523 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.596 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.359 0.6 . . . . 0.0 111.106 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -44.84 -49.31 10.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.621 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.868 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.3 OUTLIER -62.53 -39.11 92.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.122 0.487 . . . . 0.0 109.894 178.996 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.596 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.63 -30.25 20.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.293 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -27.91 41.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.777 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 5.5 p -75.3 -41.79 56.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.261 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.026 HG22 HD11 ' A' ' 14' ' ' ILE . 1.9 mp -68.26 -53.81 26.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.869 0.366 . . . . 0.0 111.301 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.897 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -51.88 -27.29 12.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.101 -178.651 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' VAL . 9.1 m -73.65 -56.05 5.5 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.916 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.6 mm? -63.43 -28.76 70.19 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.026 HD11 HG22 ' A' ' 10' ' ' ILE . 14.4 mt -68.97 -38.53 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.881 0 CA-C-O 121.593 0.711 . . . . 0.0 110.894 179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -78.46 -31.38 47.89 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.786 -175.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.916 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.9 m -54.34 -40.77 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.624 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -81.71 -55.48 4.61 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -178.752 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.966 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -62.9 -24.76 67.99 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.733 -177.302 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -51.38 62.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 9.8 m-85 -81.38 -29.01 34.13 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.815 176.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.966 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -85.88 20.25 2.28 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.121 -178.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.495 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.624 ' O ' HG13 ' A' ' 28' ' ' VAL . 7.1 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.904 0.383 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.2 p -154.25 160.99 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.196 0.522 . . . . 0.0 111.158 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.782 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -114.8 -116.73 0.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.009 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' A' ' 30' ' ' LEU . 23.1 t 179.98 130.16 0.09 Allowed 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.41 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 8.5 ttpt -49.73 -36.34 25.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.919 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.762 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -73.99 -45.25 51.09 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 4.2 mt-10 -55.92 -29.05 59.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.972 0.415 . . . . 0.0 110.276 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.23 -26.96 63.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.913 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.28 -58.87 5.92 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.663 0.744 . . . . 0.0 110.852 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.605 ' O ' HG22 ' A' ' 41' ' ' THR . 6.3 m -55.52 -44.95 77.15 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.815 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB ' ' A' ' 16' ' ' VAL . 50.8 t80 -57.86 -27.21 63.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.044 0.45 . . . . 0.0 110.449 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.729 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -74.15 -64.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.69 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.624 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 66.7 m-80 -56.61 -19.44 16.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.032 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . 1.048 HG23 ' HG2' ' A' ' 42' ' ' GLU . 12.2 t -98.52 -26.48 14.41 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 1.048 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -129.9 -41.15 1.32 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.634 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' A' ' 39' ' ' MET . 14.0 mt -115.31 48.03 1.23 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.267 0.556 . . . . 0.0 110.046 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.624 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -84.5 -35.68 22.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.327 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.4 -22.72 8.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.878 0.371 . . . . 0.0 110.925 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 2.3 m-85 -88.98 -29.06 19.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.798 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.729 HG21 ' HG2' ' A' ' 39' ' ' MET . 2.1 t . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.849 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.463 0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.706 HD13 ' N ' ' A' ' 57' ' ' ASP . 0.5 OUTLIER -59.72 -51.46 69.69 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.703 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.706 ' N ' HD13 ' A' ' 56' ' ' LEU . 35.9 t70 -67.81 -26.01 65.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.666 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -33.61 69.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 0.0 110.567 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.868 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -75.11 -54.3 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.648 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.709 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 1.9 mtm . . . . . 0 C--N 1.326 -0.441 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.774 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 3.3 mm100 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.75 0.309 . . . . 0.0 111.052 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.933 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.8 -133.53 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.725 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 20.7 t70 160.37 165.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 118.895 0.77 . . . . 0.0 111.121 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.632 ' CG ' HG11 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -46.46 -56.45 5.92 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.265 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.57 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 5.4 tp-100 -79.01 -33.25 45.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.521 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.933 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -44.79 -31.98 1.39 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HD1' HD12 ' A' ' 71' ' ' LEU . 1.5 m-85 -80.51 -54.76 5.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.708 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -61.69 -33.71 74.48 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.688 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -36.62 70.15 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.3 mp -65.74 -57.75 7.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.764 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.978 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.65 -41.99 48.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.493 179.197 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.75 -49.99 51.52 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.77 -37.09 42.4 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 111.614 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.856 HD21 ' HE2' ' A' ' 59' ' ' MET . 5.4 mt -62.57 -47.49 83.62 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.807 0.337 . . . . 0.0 110.36 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.544 ' HB2' ' CG2' ' B' ' 10' ' ' ILE . . . -55.61 -30.8 61.53 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.361 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.627 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.19 -17.34 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.787 -178.937 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.687 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -115.44 7.69 15.08 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.622 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.442 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -145.8 -42.79 0.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.436 ' CD2' HG21 ' B' ' 10' ' ' ILE . 12.7 m-70 -85.83 176.44 8.1 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.51 2.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.494 ' O ' HG21 ' B' ' 28' ' ' VAL . 0.1 OUTLIER -170.54 -56.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.823 -179.909 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.427 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -125.33 -44.49 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.295 -179.954 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.592 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.185 0 CA-C-O 121.404 0.621 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -44.9 -49.26 11.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.629 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.876 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.4 OUTLIER -62.62 -39.01 92.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.095 0.474 . . . . 0.0 109.889 179.027 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.592 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.74 -30.26 21.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.282 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.54 -27.8 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.8 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB2' HD22 ' A' ' 13' ' ' LEU . 5.6 p -75.3 -41.84 56.05 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.26 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.012 HG22 HD11 ' B' ' 14' ' ' ILE . 1.9 mp -68.24 -53.76 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.4 . . . . 0.0 111.354 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.914 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.5 OUTLIER -51.91 -27.27 12.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.075 -178.663 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.629 ' O ' HG13 ' B' ' 16' ' ' VAL . 8.9 m -73.71 -56.04 5.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.6 mm? -63.48 -28.67 70.12 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.012 HD11 HG22 ' B' ' 10' ' ' ILE . 14.5 mt -69.04 -38.38 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.884 0 CA-C-O 121.508 0.671 . . . . 0.0 110.881 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' ALA . . . . . 0.515 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -78.59 -31.34 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.113 -1.403 . . . . 0.0 112.744 -175.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.902 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.0 m -54.38 -40.77 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -81.72 -55.41 4.65 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -178.689 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.939 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -62.86 -24.82 67.99 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.69 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.33 -51.37 62.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.503 ' HB3' HD21 ' B' ' 30' ' ' LEU . 9.7 m-85 -81.38 -28.97 34.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.835 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.939 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -85.89 20.29 2.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.116 -178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.55 179.883 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.629 ' O ' HG13 ' B' ' 28' ' ' VAL . 7.1 p . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.946 0.403 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 9.3 p -154.25 160.96 42.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.261 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.76 ' HB2' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -114.84 -116.75 0.32 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.997 179.474 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' B' ' 30' ' ' LEU . 23.1 t -179.99 130.24 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.421 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 8.5 ttpt -49.83 -36.27 26.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.891 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.764 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.08 -45.26 50.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.481 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 4.2 mt-10 -55.9 -28.99 59.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.352 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.19 -27.04 63.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.881 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.764 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.27 -58.92 5.73 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.616 0.722 . . . . 0.0 110.825 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.607 ' O ' HG22 ' B' ' 41' ' ' THR . 6.2 m -55.49 -44.86 76.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.878 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.467 ' HA ' HG22 ' B' ' 41' ' ' THR . 50.6 t80 -58.01 -27.13 63.25 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.464 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.731 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -74.19 -64.48 1.01 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.762 179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.625 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 66.8 m-80 -56.57 -19.66 16.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.983 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' THR . . . . . 1.049 HG23 ' HG2' ' B' ' 42' ' ' GLU . 12.1 t -98.4 -26.36 14.5 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 1.049 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.2 OUTLIER -129.92 -41.19 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' B' ' 39' ' ' MET . 13.9 mt -115.35 48.07 1.23 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -84.58 -35.59 22.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.389 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.67 8.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.949 0.404 . . . . 0.0 111.008 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 2.4 m-85 -89.01 -29.0 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.782 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.731 HG21 ' HG2' ' B' ' 39' ' ' MET . 2.1 t . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.462 0.138 0 CA-C-O 121.045 0.45 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.695 HD13 ' N ' ' B' ' 57' ' ' ASP . 0.5 OUTLIER -59.74 -51.38 70.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.755 -179.535 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.695 ' N ' HD13 ' B' ' 56' ' ' LEU . 35.9 t70 -67.88 -26.08 65.83 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.575 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -33.66 69.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.848 0.356 . . . . 0.0 110.607 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.895 ' HE2' HD21 ' B' ' 83' ' ' LEU . 0.3 OUTLIER -75.18 -54.26 7.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.581 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.589 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 1.9 mtm . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 3.3 mm100 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.731 0.301 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.91 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.76 -133.48 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.728 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 20.7 t70 160.36 165.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 118.93 0.786 . . . . 0.0 111.079 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.627 ' CG ' HG11 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -46.43 -56.4 5.97 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.303 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.562 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 5.4 tp-100 -79.07 -33.25 44.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.489 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.91 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.3 OUTLIER -44.8 -31.97 1.4 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.872 0.368 . . . . 0.0 110.317 179.361 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.649 ' HD1' HD12 ' B' ' 71' ' ' LEU . 1.5 m-85 -80.49 -54.62 5.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.787 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -61.72 -33.76 74.6 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.716 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -36.7 70.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.862 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.3 mp -65.67 -57.7 7.45 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.74 -41.85 47.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.781 0.324 . . . . 0.0 110.496 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -49.95 52.3 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.439 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.74 -37.08 42.1 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.64 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.895 HD21 ' HE2' ' B' ' 59' ' ' MET . 5.4 mt -62.69 -47.43 83.68 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.548 ' HB2' ' CG2' ' A' ' 10' ' ' ILE . . . -55.62 -30.7 61.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.172 0.511 . . . . 0.0 111.461 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.632 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.37 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.785 -179.02 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.675 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -115.49 7.71 15.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.533 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.444 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -145.72 -42.78 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.009 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.8 m-70 -85.9 176.41 8.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.42 2.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.507 ' O ' HG21 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -170.45 -56.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.871 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.436 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -125.37 -44.45 1.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.878 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.673 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 121.394 0.616 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -44.04 9.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.348 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.849 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -68.67 -38.15 80.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.275 179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.673 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.2 OUTLIER -52.04 -37.13 52.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.68 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.38 -26.77 41.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.816 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.473 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.34 66.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.392 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.088 HG22 HD11 ' A' ' 14' ' ' ILE . 2.1 mp -61.01 -57.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.69 0.281 . . . . 0.0 111.066 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.906 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -53.84 -27.57 30.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.183 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.56 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -62.7 -55.5 26.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.781 -179.54 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.018 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -71.35 -41.76 69.36 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.088 HD11 HG22 ' A' ' 10' ' ' ILE . 5.0 mt -56.11 -29.33 26.97 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 CA-C-O 121.083 0.468 . . . . 0.0 112.128 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.14 -32.89 21.06 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.526 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.018 HG22 ' O ' ' A' ' 13' ' ' LEU . 14.2 m -54.7 -31.4 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.749 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.34 -58.09 3.3 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.335 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.9 mm-40 -48.5 -30.86 5.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.6 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -61.96 -51.36 68.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.866 0.365 . . . . 0.0 110.505 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.682 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -80.42 -32.95 37.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.748 0.785 . . . . 0.0 109.563 178.312 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.587 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . . . -90.4 19.9 4.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.854 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.399 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 p . . . . . 0 CA--C 1.527 0.096 0 CA-C-O 120.685 0.279 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.26 -176.51 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.193 0.521 . . . . 0.0 111.357 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -135.38 -129.07 0.15 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.177 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.673 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -173.86 131.06 0.41 Allowed 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.53 -42.58 44.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 0.0 110.619 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 1.058 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -75.2 -43.12 53.75 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.192 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.518 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.1 mt-10 -55.28 -28.87 56.39 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.402 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.7 19.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.091 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 1.058 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.7 62.12 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.089 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -81.4 -53.81 5.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.272 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -62.31 -36.02 80.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.296 179.494 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.577 ' HE2' HD13 ' A' ' 43' ' ' LEU . 4.2 ttm -46.67 -36.94 7.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.128 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.665 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 23.2 m-80 -64.0 -19.33 65.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.186 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.962 HG23 ' HG2' ' A' ' 42' ' ' GLU . 4.6 t -84.12 -30.71 25.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.962 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.0 OUTLIER -135.35 -38.01 0.76 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.191 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.83 HD21 HD11 ' B' ' 10' ' ' ILE . 19.0 mt -104.65 36.09 2.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.39 0.614 . . . . 0.0 110.146 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -79.4 -38.24 35.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.11 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.75 -24.23 14.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.821 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.468 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 3.1 m-85 -100.27 27.11 5.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.784 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.5 p . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.059 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.523 HG22 ' HB1' ' A' ' 86' ' ' ALA . 85.6 t . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.661 0.267 . . . . 0.0 111.285 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.756 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -69.39 -51.61 34.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.298 0.57 . . . . 0.0 110.208 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.756 ' N ' HD23 ' A' ' 56' ' ' LEU . 2.9 t0 -54.6 -26.71 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.607 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.99 -53.03 62.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.663 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.859 ' CE ' HD21 ' A' ' 83' ' ' LEU . 2.5 ptp -60.54 -53.73 53.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.01 0.433 . . . . 0.0 110.456 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.67 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.3 mtm . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.757 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 6.5 mm100 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.487 0.184 . . . . 0.0 110.609 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -63.71 -140.45 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.51 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.6 OUTLIER 165.61 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.256 0.55 . . . . 0.0 111.392 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.865 ' CD1' HG11 ' B' ' 85' ' ' VAL . 0.8 OUTLIER -46.05 -61.81 1.6 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.603 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.585 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.18 -30.43 38.81 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.267 -179.35 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.4 OUTLIER -46.58 -31.35 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.784 179.397 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.589 ' HB3' ' CD1' ' A' ' 17' ' ' PHE . 0.8 OUTLIER -79.36 -54.38 6.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.771 178.332 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.52 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 6.3 mt -61.07 -34.04 74.28 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.617 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.413 ' HB3' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -72.38 -34.57 68.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.054 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.847 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 0.3 OUTLIER -67.83 -57.83 5.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.685 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.973 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.27 -43.77 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.112 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.02 -50.35 51.66 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.81 -37.32 43.25 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.659 177.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.859 HD21 ' CE ' ' A' ' 59' ' ' MET . 7.6 mt -64.01 -45.46 88.85 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.737 0.303 . . . . 0.0 110.219 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 88' ' ' HIS . . . -55.25 -32.75 62.58 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.338 0.59 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CD1' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.48 9.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.666 -179.487 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -113.32 12.08 18.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.299 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.92 -39.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.677 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.468 ' NE2' ' CE2' ' A' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.61 12.26 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.774 0.321 . . . . 0.0 111.19 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.7 89.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.152 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.415 ' H ' HG22 ' A' ' 92' ' ' VAL . 1.1 m 176.55 107.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.664 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.752 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 75.88 -48.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 85' ' ' VAL . 31.2 m . . . . . 0 C--N 1.332 -0.16 0 CA-C-O 120.885 0.374 . . . . 0.0 111.654 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.661 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 0.0 111.171 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -43.95 9.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.326 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.853 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -68.77 -38.08 79.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.277 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.661 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.2 OUTLIER -52.12 -37.04 52.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.667 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -26.88 42.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.802 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.468 ' SG ' HG11 ' A' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.39 66.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.397 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.056 HG22 HD11 ' B' ' 14' ' ' ILE . 2.1 mp -60.96 -56.9 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 120.768 0.318 . . . . 0.0 111.132 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.904 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -54.0 -27.51 32.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.19 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -62.67 -55.54 25.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.817 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 1.024 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -71.37 -41.72 69.36 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.056 HD11 HG22 ' B' ' 10' ' ' ILE . 5.0 mt -56.1 -29.3 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 121.913 -0.492 . . . . 0.0 112.136 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.13 -32.84 21.09 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.554 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 1.024 HG22 ' O ' ' B' ' 13' ' ' LEU . 14.4 m -54.74 -31.4 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.74 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.28 -58.16 3.27 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.373 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.783 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.9 mm-40 -48.56 -30.73 5.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.622 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -62.06 -51.31 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.873 0.368 . . . . 0.0 110.495 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.679 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.31 -33.05 37.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.804 0.812 . . . . 0.0 109.631 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.599 ' HB2' ' HB2' ' B' ' 30' ' ' LEU . . . -90.42 20.04 4.8 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.213 -1.358 . . . . 0.0 111.743 -178.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.406 179.919 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.598 0.237 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.22 -176.4 4.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.363 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.679 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -135.48 -129.14 0.15 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.183 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.67 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -173.82 131.04 0.42 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.49 -42.62 43.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.82 0.343 . . . . 0.0 110.643 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' THR . . . . . 1.017 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -75.18 -43.14 53.87 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.256 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.509 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.1 mt-10 -55.13 -28.98 56.62 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.401 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.72 19.44 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.038 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 1.017 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.84 62.15 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.987 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.409 ' N ' ' O ' ' B' ' 33' ' ' THR . 2.1 t -81.31 -53.8 6.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.309 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.883 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -62.44 -35.86 80.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.363 179.553 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.558 ' HE2' HD13 ' B' ' 43' ' ' LEU . 4.1 ttm -46.79 -36.87 7.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.005 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.659 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 23.2 m-80 -64.01 -19.46 65.2 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.952 HG23 ' HG2' ' B' ' 42' ' ' GLU . 4.5 t -83.94 -30.82 25.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.0 OUTLIER -135.4 -37.94 0.76 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -178.118 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.826 HD21 HD11 ' A' ' 10' ' ' ILE . 19.0 mt -104.68 36.07 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.41 0.624 . . . . 0.0 110.184 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.659 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -79.37 -38.23 35.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.14 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.69 -24.32 14.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.805 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.459 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 3.1 m-85 -100.25 27.12 5.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.77 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 82.6 p . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.042 -179.931 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.535 HG22 ' HB1' ' B' ' 86' ' ' ALA . 86.6 t . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.706 0.289 . . . . 0.0 111.261 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.755 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -69.35 -51.72 34.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 110.175 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.755 ' N ' HD23 ' B' ' 56' ' ' LEU . 2.9 t0 -54.5 -26.85 33.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.9 -53.08 62.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.617 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.87 ' CE ' HD21 ' B' ' 83' ' ' LEU . 2.5 ptp -60.56 -53.8 53.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.373 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.699 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.2 mtm . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.75 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.467 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 6.4 mm100 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.485 0.183 . . . . 0.0 110.536 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 1.038 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -63.7 -140.45 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.982 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.506 ' O ' ' CE2' ' B' ' 76' ' ' PHE . 0.6 OUTLIER 165.66 175.7 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.177 0.513 . . . . 0.0 111.428 178.733 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CD1' HG11 ' A' ' 85' ' ' VAL . 0.9 OUTLIER -46.04 -61.8 1.6 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -177.639 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.582 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.29 -30.42 38.28 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.211 -179.266 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 1.038 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.4 OUTLIER -46.45 -31.49 2.72 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.873 179.331 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.593 ' HB3' ' CD1' ' B' ' 17' ' ' PHE . 0.8 OUTLIER -79.18 -54.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 120.462 -0.495 . . . . 0.0 109.818 178.242 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.526 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 6.3 mt -60.96 -34.02 74.11 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.716 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.405 ' HB3' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -72.44 -34.55 67.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.043 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.829 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 0.3 OUTLIER -67.86 -57.82 5.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.645 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.981 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.23 -43.77 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.135 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.1 -50.34 52.0 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.438 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.86 -37.34 43.67 Favored Glycine 0 CA--C 1.52 0.405 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.633 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.87 HD21 ' CE ' ' B' ' 59' ' ' MET . 7.7 mt -64.02 -45.34 89.34 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.773 0.321 . . . . 0.0 110.253 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.457 ' HA ' ' CD2' ' B' ' 88' ' ' HIS . . . -55.32 -32.78 62.76 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.3 0.572 . . . . 0.0 110.663 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.865 HG11 ' CD1' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.34 -17.29 9.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.727 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.535 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -113.41 12.1 18.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.368 -179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.89 -39.66 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.678 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.459 ' NE2' ' CE2' ' B' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.63 12.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.819 0.343 . . . . 0.0 111.143 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.69 89.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.154 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.409 ' H ' HG22 ' B' ' 92' ' ' VAL . 1.1 m 176.54 107.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.626 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.749 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 75.91 -49.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.156 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.441 HG13 ' O ' ' B' ' 85' ' ' VAL . 30.9 m . . . . . 0 C--N 1.333 -0.13 0 CA-C-O 120.862 0.363 . . . . 0.0 111.663 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.641 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 121.482 0.658 . . . . 0.0 111.392 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 6' ' ' THR . 0.7 OUTLIER -45.01 -48.24 11.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.303 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.9 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.7 m -65.26 -39.7 92.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.385 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.641 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.3 mm-40 -51.76 -45.91 63.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.498 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -26.78 60.93 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.569 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -63.6 -52.31 61.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.956 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -55.69 -57.12 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 120.694 0.283 . . . . 0.0 111.056 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.881 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.8 OUTLIER -54.59 -27.42 38.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.025 0.44 . . . . 0.0 110.756 179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.789 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.07 -55.51 24.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.081 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' B' ' 13' ' ' LEU . 4.0 mm? -72.14 -30.97 65.55 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.022 HD11 HG22 ' A' ' 10' ' ' ILE . 5.5 mt -69.8 -38.25 75.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 111.95 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.65 64.06 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.678 -1.147 . . . . 0.0 112.023 -176.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.9 m -52.27 -40.0 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.506 ' N ' HG23 ' A' ' 16' ' ' VAL . 31.3 t80 -72.85 -58.21 3.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.296 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.793 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.0 mm-40 -49.09 -49.02 43.74 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -51.28 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.525 -178.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.502 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.6 m-85 -80.59 -26.87 37.61 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.59 0.709 . . . . 0.0 110.206 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.748 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -90.39 20.07 4.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.781 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.26 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.556 -179.918 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.8 m . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.595 0.236 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.748 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 24.1 p -155.17 -176.91 6.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.989 0.423 . . . . 0.0 110.812 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 31' ' ' SER . 0.3 OUTLIER -147.78 -123.16 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.261 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.551 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -173.7 129.23 0.41 Allowed 'General case' 0 C--O 1.231 0.088 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.408 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -49.91 -40.71 44.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.165 -179.136 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.711 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.44 -42.72 67.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.936 0.398 . . . . 0.0 110.041 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.0 mt-10 -56.01 -29.65 60.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -68.62 -34.88 76.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.535 178.441 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -53.37 -59.08 5.03 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.699 0.761 . . . . 0.0 111.192 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' HG22 ' A' ' 41' ' ' THR . 3.0 t -57.88 -27.75 63.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.34 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' B' ' 6' ' ' THR . 8.7 t80 -57.69 -50.39 73.35 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.012 0.434 . . . . 0.0 110.267 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.719 ' HE3' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.39 -44.14 95.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.444 0.64 . . . . 0.0 110.107 179.05 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.44 -19.29 64.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.932 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 37' ' ' SER . 8.3 t -107.61 -52.69 2.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.455 ' N ' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -128.09 29.2 5.42 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -177.149 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.719 HD13 ' HE3' ' A' ' 39' ' ' MET . 7.8 mt -166.7 45.8 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.17 0.51 . . . . 0.0 110.604 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.87 -30.0 61.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.361 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.47 -29.49 61.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.879 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CD1' HD22 ' A' ' 43' ' ' LEU . 4.4 m-85 -83.28 -4.63 58.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.702 HG21 ' HB3' ' A' ' 39' ' ' MET . 1.4 p . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.668 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' A' ' 86' ' ' ALA . 48.9 t . . . . . 0 CA--C 1.527 0.06 0 CA-C-O 120.918 0.39 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.665 HD23 ' C ' ' A' ' 56' ' ' LEU . 7.0 tt -75.16 -52.15 11.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.969 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.48 -26.81 44.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.028 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -53.79 30.68 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.696 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -75.55 -43.09 50.41 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.11 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.443 ' HE1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.664 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 3.5 mm100 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.891 0.377 . . . . 0.0 111.109 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 71' ' ' LEU . 0.4 OUTLIER -69.37 -137.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.635 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 2.5 t70 173.72 161.49 0.16 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.466 0.575 . . . . 0.0 110.879 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.939 ' CD2' HG11 ' B' ' 85' ' ' VAL . 51.5 p90 -55.39 -58.85 6.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.289 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -79.96 -22.59 42.44 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 119.824 -0.751 . . . . 0.0 110.516 -179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.5 mt-10 -44.76 -38.09 4.22 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.506 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 1.4 t80 -76.84 -54.71 6.25 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 177.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' B' ' 77' ' ' LEU . 0.0 OUTLIER -48.55 -33.94 10.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.899 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.599 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -76.38 -52.39 9.99 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.686 178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.978 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -58.5 -59.07 5.95 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.951 -179.073 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.24 -41.41 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 O-C-N 123.606 0.566 . . . . 0.0 111.212 179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.459 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.83 -50.82 48.55 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 119.68 -1.247 . . . . 0.0 110.22 178.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -60.71 -35.91 90.66 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 120.455 -0.879 . . . . 0.0 111.846 177.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.978 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.8 mt -63.92 -38.32 90.66 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.3 -35.73 65.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.095 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.938 HG11 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.81 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.67 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -113.86 16.14 18.46 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.163 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.406 ' N ' ' O ' ' A' ' 83' ' ' LEU . 45.1 t -162.76 -42.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.825 -179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -99.01 78.78 2.29 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 111.855 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 90' ' ' SER . 6.0 mp0 53.37 -163.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.292 179.244 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 3.2 m 81.7 -69.56 0.08 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.247 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.57 -37.52 4.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.054 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 92' ' ' VAL . 4.2 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.651 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.429 0.633 . . . . 0.0 111.476 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 5' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' B' ' 6' ' ' THR . 0.7 OUTLIER -44.96 -48.25 11.4 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.255 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 20.1 m -65.31 -39.69 92.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.326 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.651 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.74 -45.87 63.83 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.458 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -26.77 60.86 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.563 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -63.48 -52.41 61.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.032 179.791 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.124 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -55.6 -57.07 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.638 0.256 . . . . 0.0 111.117 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.8 OUTLIER -54.67 -27.43 40.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 110.729 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.804 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.05 -55.52 24.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.084 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' A' ' 13' ' ' LEU . 4.0 mm? -72.16 -31.02 65.56 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.124 HD11 HG22 ' B' ' 10' ' ' ILE . 5.6 mt -69.8 -38.2 75.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.344 0.592 . . . . 0.0 111.902 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.18 -34.58 63.82 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.963 -176.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' B' ' 13' ' ' LEU . 16.0 m -52.27 -40.07 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 177.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.502 ' N ' HG23 ' B' ' 16' ' ' VAL . 31.4 t80 -72.77 -58.1 3.6 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.422 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.0 mm-40 -49.32 -48.84 46.04 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.28 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.66 -51.25 22.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.511 -178.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.521 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.6 m-85 -80.53 -26.9 37.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.521 0.677 . . . . 0.0 110.144 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -90.4 20.03 4.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.705 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.594 -179.906 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.692 0.282 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.744 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 24.2 p -155.16 -176.98 6.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.016 0.436 . . . . 0.0 110.839 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.558 HD22 ' N ' ' B' ' 31' ' ' SER . 0.3 OUTLIER -147.74 -123.2 0.06 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.31 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.558 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.3 OUTLIER -173.66 129.21 0.42 Allowed 'General case' 0 C--O 1.231 0.116 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.32 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.413 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -49.8 -40.79 42.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.19 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.722 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.34 -42.77 68.12 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.075 179.591 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.511 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.0 mt-10 -55.92 -29.77 60.58 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -68.57 -34.86 76.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.521 178.525 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.722 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -53.4 -59.12 4.99 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 111.123 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.525 ' O ' HG22 ' B' ' 41' ' ' THR . 3.0 t -57.84 -27.74 63.47 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.386 -178.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' A' ' 6' ' ' THR . 8.6 t80 -57.64 -50.49 72.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.979 0.418 . . . . 0.0 110.26 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.698 ' HB3' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -60.32 -44.07 95.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.438 0.637 . . . . 0.0 110.147 179.064 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -63.5 -19.29 64.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.92 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.525 HG22 ' O ' ' B' ' 37' ' ' SER . 8.2 t -107.68 -52.59 2.74 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.451 ' N ' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -128.16 29.2 5.41 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.158 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.667 HD13 ' HE3' ' B' ' 39' ' ' MET . 7.8 mt -166.7 45.81 0.06 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.138 0.494 . . . . 0.0 110.604 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.83 -29.95 61.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.431 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.49 -29.5 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.856 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.42 ' CD1' HD22 ' B' ' 43' ' ' LEU . 4.4 m-85 -83.32 -4.61 58.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.201 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.698 HG21 ' HB3' ' B' ' 39' ' ' MET . 1.4 p . . . . . 0 CA--C 1.53 0.207 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.705 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' B' ' 86' ' ' ALA . 49.1 t . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.912 0.386 . . . . 0.0 111.534 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.655 HD23 ' C ' ' B' ' 56' ' ' LEU . 7.0 tt -75.11 -52.23 11.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.976 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.52 -26.77 44.91 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.02 -178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -53.75 31.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.705 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -75.53 -43.09 50.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.172 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.444 ' HE1' ' HG ' ' B' ' 56' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.683 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 3.5 mm100 . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.88 0.372 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.445 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.4 OUTLIER -69.25 -137.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 2.5 t70 173.69 161.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.409 0.55 . . . . 0.0 110.969 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.938 ' CD2' HG11 ' A' ' 85' ' ' VAL . 51.6 p90 -55.37 -58.83 6.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.4 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.584 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -79.92 -22.55 42.59 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.556 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.823 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.5 mt-10 -44.81 -38.11 4.29 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 1.4 t80 -76.77 -54.71 6.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -48.6 -33.85 10.54 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 177.94 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.0 OUTLIER -76.48 -52.36 9.96 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.654 178.027 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.973 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -58.55 -58.94 6.35 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.977 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.97 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.27 -41.53 65.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 O-C-N 123.572 0.545 . . . . 0.0 111.158 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.72 -50.82 47.87 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 119.75 -1.215 . . . . 0.0 110.261 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.49 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -60.77 -35.88 90.77 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.847 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.973 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.9 mt -63.87 -38.35 90.77 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.608 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.37 -35.58 65.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.098 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.939 HG11 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.54 -17.89 9.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 114.732 -1.122 . . . . 0.0 111.706 -179.538 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.78 15.98 18.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.416 ' N ' ' O ' ' B' ' 83' ' ' LEU . 45.3 t -162.74 -42.41 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.852 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.404 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.6 OUTLIER -99.12 78.86 2.28 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.923 0.392 . . . . 0.0 111.869 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' B' ' 90' ' ' SER . 6.0 mp0 53.37 -163.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.415 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.411 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 3.2 m 81.72 -69.64 0.08 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.241 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.51 -37.52 4.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.103 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.364 -179.815 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 121.328 0.585 . . . . 0.0 111.049 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.76 -46.44 10.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.114 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.999 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.19 -41.76 96.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.18 0.514 . . . . 0.0 109.932 179.057 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.5 mt-10 -51.66 -34.71 39.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.37 -35.43 40.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.842 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HB2' HD22 ' B' ' 13' ' ' LEU . 3.4 p -65.45 -40.7 93.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.066 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.039 HG22 HD11 ' A' ' 14' ' ' ILE . 2.6 mp -69.89 -56.17 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.402 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.1 -27.47 14.18 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.604 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.636 ' O ' HG13 ' A' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.887 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.953 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -59.75 -29.67 68.33 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.118 0.485 . . . . 0.0 112.086 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.039 HD11 HG22 ' A' ' 10' ' ' ILE . 8.0 mt -70.66 -39.04 75.37 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 CA-C-O 121.541 0.686 . . . . 0.0 110.539 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.5 -32.79 58.53 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.293 -176.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.953 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.0 m -52.09 -39.09 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.497 ' N ' HG23 ' A' ' 16' ' ' VAL . 9.1 t80 -77.85 -58.47 3.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.917 179.058 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.6 mm-40 -48.84 -30.97 6.39 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -51.56 68.95 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.804 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.763 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.05 -49.38 10.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.794 0.807 . . . . 0.0 109.962 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -57.25 -52.12 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.782 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 -179.964 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.9 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.99 0.424 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 31.7 p -123.57 -178.33 3.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.262 0.553 . . . . 0.0 111.031 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -131.73 -139.86 0.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.787 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.516 ' H ' HD22 ' A' ' 30' ' ' LEU . 1.3 p -164.33 136.72 4.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 3.4 pttt -49.72 -35.76 23.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.925 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.951 ' HA ' HD23 ' A' ' 36' ' ' LEU . 12.9 m -74.28 -53.18 10.26 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.856 -0.338 . . . . 0.0 111.779 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.462 ' HB3' ' CD1' ' A' ' 20' ' ' TYR . 25.4 mt-10 -55.63 -28.2 53.96 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.54 ' CE2' ' CD2' ' A' ' 76' ' ' PHE . 1.3 t80 -78.18 -43.02 29.73 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.209 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.951 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -68.23 -21.02 64.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.48 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -80.99 -26.55 36.42 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.141 0.496 . . . . 0.0 109.831 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.464 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 45.8 t80 -69.5 -24.48 63.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.666 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.593 ' CG ' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -72.44 -41.68 65.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.615 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -73.99 -19.4 60.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.4 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.4 p -106.32 -76.53 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 38' ' ' PHE . 2.0 mm-40 -68.41 -33.15 73.71 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.778 HD22 ' CD2' ' A' ' 46' ' ' PHE . 15.5 mt -121.95 43.73 2.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.074 0.464 . . . . 0.0 110.686 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -74.68 -25.02 58.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.809 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.08 -23.23 67.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.812 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.778 ' CD2' HD22 ' A' ' 43' ' ' LEU . 16.2 m-85 -95.55 -27.89 15.13 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.915 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.593 HG21 ' CG ' ' A' ' 39' ' ' MET . 11.7 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.839 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 86' ' ' ALA . 23.6 t . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 121.066 0.46 . . . . 0.0 111.437 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.546 HD13 ' CG ' ' A' ' 39' ' ' MET . 7.8 tp -75.1 -51.23 13.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.735 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.65 -33.76 64.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.489 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -40.31 95.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.694 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.883 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -61.69 -54.21 45.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.041 0.448 . . . . 0.0 111.199 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.558 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.431 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.402 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 7.3 mm100 . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.903 0.382 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.716 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.72 -142.5 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.403 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.491 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 171.74 -178.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.23 0.538 . . . . 0.0 111.731 179.121 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.5 p90 -61.77 -58.15 9.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.639 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.521 ' NE2' ' HB2' ' A' ' 77' ' ' LEU . 7.1 tp-100 -74.74 -25.38 59.07 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.608 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.789 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.95 -37.57 4.07 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.54 ' CD2' ' CE2' ' A' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.47 5.73 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.833 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.675 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.5 mt -53.98 -33.89 58.26 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.428 ' HB3' ' O ' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.79 -50.05 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.242 177.874 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.789 HD13 ' O ' ' A' ' 75' ' ' GLU . 5.0 mp -58.05 -57.52 12.47 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.016 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HG12 ' B' ' 10' ' ' ILE . 0.1 OUTLIER -71.1 -46.03 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.027 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.668 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.91 -50.13 51.96 Favored Glycine 0 C--N 1.333 0.412 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.65 -35.12 37.17 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.687 178.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.883 HD21 ' CE ' ' A' ' 59' ' ' MET . 12.6 mt -61.74 -45.99 91.57 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.965 0.412 . . . . 0.0 109.979 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.48 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.37 -31.81 62.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.873 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.902 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.41 9.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.649 -179.598 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.761 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.73 13.01 17.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.341 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.77 -39.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.578 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.39 67.15 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.697 0.284 . . . . 0.0 111.737 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.7 -168.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m 76.09 5.51 3.75 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.652 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.503 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER 170.35 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 179.674 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.165 179.976 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.682 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.317 0.58 . . . . 0.0 111.142 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.69 -46.48 10.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.094 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.99 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.16 -41.82 97.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.894 179.048 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.682 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.5 mt-10 -51.65 -34.71 39.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.936 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.41 -35.38 40.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.757 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.616 ' HB2' HD22 ' A' ' 13' ' ' LEU . 3.4 p -65.62 -40.59 92.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.07 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.6 mp -69.85 -56.2 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.412 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.959 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.14 -27.43 14.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.878 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.932 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -59.84 -29.56 68.36 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.12 0.486 . . . . 0.0 112.085 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.0 mt -70.73 -38.96 74.99 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 121.478 0.656 . . . . 0.0 110.526 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.8 58.43 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.387 -1.279 . . . . 0.0 112.311 -176.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.932 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.2 m -52.15 -39.05 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 177.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.496 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 9.0 t80 -77.9 -58.52 3.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.839 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.809 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.7 mm-40 -48.91 -30.84 6.36 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -51.65 68.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.702 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.753 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.94 -49.39 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.869 0.842 . . . . 0.0 109.995 178.459 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -57.28 -52.08 66.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.23 -1.35 . . . . 0.0 111.859 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.987 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' B' ' 28' ' ' VAL . 26.8 m . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.004 0.431 . . . . 0.0 111.018 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.9 p -123.65 -178.36 4.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.248 0.546 . . . . 0.0 111.025 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.753 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -131.63 -139.83 0.21 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.877 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.496 ' H ' HD22 ' B' ' 30' ' ' LEU . 1.3 p -164.43 136.63 4.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -49.59 -35.67 21.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.991 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.959 ' HA ' HD23 ' B' ' 36' ' ' LEU . 12.5 m -74.46 -53.06 10.28 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.755 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' ' CD1' ' B' ' 20' ' ' TYR . 25.4 mt-10 -55.68 -28.17 54.14 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.547 ' CE2' ' CD2' ' B' ' 76' ' ' PHE . 1.3 t80 -78.27 -42.95 29.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.183 178.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.959 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -68.3 -20.98 64.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.474 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -81.03 -26.54 36.31 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.133 0.492 . . . . 0.0 109.832 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB2' ' CE2' ' B' ' 20' ' ' TYR . 45.9 t80 -69.46 -24.54 63.81 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.588 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.6 ' CG ' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -72.39 -41.65 66.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.611 -179.595 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 0.1 OUTLIER -74.08 -19.34 60.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.349 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 28.5 p -106.32 -76.68 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.454 ' CB ' ' CZ ' ' B' ' 38' ' ' PHE . 2.0 mm-40 -68.33 -33.06 73.61 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.77 HD22 ' CD2' ' B' ' 46' ' ' PHE . 15.3 mt -122.16 43.93 2.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.134 0.492 . . . . 0.0 110.589 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.566 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -74.69 -25.03 58.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.88 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.05 -23.24 67.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.784 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.77 ' CD2' HD22 ' B' ' 43' ' ' LEU . 16.2 m-85 -95.59 -27.94 15.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.934 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.6 HG21 ' CG ' ' B' ' 39' ' ' MET . 11.7 t . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.918 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.773 HG22 ' O ' ' B' ' 86' ' ' ALA . 23.7 t . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 121.078 0.466 . . . . 0.0 111.426 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.544 HD13 ' CG ' ' B' ' 39' ' ' MET . 7.7 tp -75.06 -51.24 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.723 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.62 -33.76 64.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.508 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -40.3 95.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -61.78 -54.24 45.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.176 -179.4 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.568 ' HE3' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.687 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.48 -179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.775 0.321 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.718 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -65.86 -142.44 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.417 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.485 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 171.75 -178.29 0.06 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.197 0.523 . . . . 0.0 111.799 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.902 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.0 p90 -61.77 -58.22 8.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.648 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.516 ' NE2' ' HB2' ' B' ' 77' ' ' LEU . 7.2 tp-100 -74.67 -25.37 59.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.623 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.87 -37.63 4.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.192 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.547 ' CD2' ' CE2' ' B' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.33 5.86 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.866 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.668 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.4 mt -54.15 -33.81 58.86 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.426 ' HB3' ' O ' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.85 -50.02 14.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.233 177.884 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.795 HD13 ' O ' ' B' ' 75' ' ' GLU . 5.0 mp -58.01 -57.65 11.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.955 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.754 HD11 HG12 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -70.94 -46.13 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.071 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.675 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.89 -50.22 51.43 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.15 36.5 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.68 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 12.7 mt -61.66 -45.98 91.7 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 121.032 0.444 . . . . 0.0 110.009 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.506 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.39 -31.7 62.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.007 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.38 -17.52 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.61 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.773 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.63 12.96 17.34 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.361 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.474 ' HG ' ' HD1' ' B' ' 46' ' ' PHE . 0.5 OUTLIER -157.79 -39.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.625 -179.63 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.29 67.07 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.75 -168.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.363 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 7.8 m 76.1 5.4 3.75 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.622 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.502 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.2 OUTLIER 170.36 -52.04 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.78 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.126 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.688 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.191 0 CA-C-O 121.374 0.607 . . . . 0.0 111.059 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.81 -47.76 10.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.034 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.905 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -63.42 -39.18 93.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.218 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.688 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.6 OUTLIER -52.28 -34.28 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.39 -39.68 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.01 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.8 p -58.6 -42.47 88.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.431 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.041 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -67.5 -56.05 14.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.906 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.88 -27.34 12.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.538 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.5 m -71.58 -55.84 7.0 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.946 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -63.55 -28.42 69.93 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.041 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -70.64 -37.01 67.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.574 0.702 . . . . 0.0 110.645 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.47 -33.08 58.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.278 -176.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.946 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.5 m -53.19 -38.95 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 177.181 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.572 ' CD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -75.25 -57.7 3.73 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.535 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.1 mm100 -48.87 -30.39 5.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -52.12 66.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.501 -0.479 . . . . 0.0 111.147 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.882 ' HB3' HD21 ' A' ' 30' ' ' LEU . 17.4 m-85 -81.17 -47.81 12.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.98 -25.05 57.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.645 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.349 -179.887 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.586 0.232 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 16.6 p -139.32 178.73 6.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.127 0.489 . . . . 0.0 111.148 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.882 HD21 ' HB3' ' A' ' 20' ' ' TYR . 1.3 tt -125.27 -115.28 0.29 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.968 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.506 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 43.2 t 176.01 129.14 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.67 -35.7 22.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.717 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.2 -44.15 54.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -58.48 -28.84 65.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 0.0 110.1 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -70.49 -27.95 64.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.917 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.717 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.46 -58.98 5.72 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.677 0.751 . . . . 0.0 111.121 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.951 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 m -56.17 -44.09 79.02 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.46 -178.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' B' ' 6' ' ' THR . 10.2 t80 -57.57 -29.08 64.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.812 0.339 . . . . 0.0 110.748 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -76.52 -41.28 47.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.099 0.476 . . . . 0.0 110.759 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -73.67 -19.46 60.82 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.244 -179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 37' ' ' SER . 0.7 OUTLIER -98.18 -66.93 0.87 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.597 ' H ' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -96.29 -20.98 18.12 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -176.172 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.585 HD21 HD11 ' B' ' 10' ' ' ILE . 31.3 mt -120.61 45.89 2.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.203 0.525 . . . . 0.0 110.59 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -32.08 35.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.077 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.47 -23.65 51.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.839 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -90.42 -8.48 50.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.112 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.436 ' CG2' ' HG2' ' A' ' 39' ' ' MET . 6.7 p . . . . . 0 C--N 1.332 -0.177 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.008 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.782 0.325 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.2 OUTLIER -64.37 -50.37 67.98 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.89 -45.13 78.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -25.33 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.891 0.377 . . . . 0.0 110.967 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . 1.032 ' HG3' HD21 ' A' ' 83' ' ' LEU . 9.5 mmm -65.62 -54.6 25.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.489 0.662 . . . . 0.0 112.006 -179.034 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.677 ' HA ' ' HE3' ' A' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.239 0 CA-C-N 114.722 -1.127 . . . . 0.0 112.409 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 10.8 mm-40 . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.862 0.363 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.4 OUTLIER -69.56 -140.7 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.542 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.6 OUTLIER 173.45 169.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 0.0 111.062 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HB2' HG11 ' B' ' 85' ' ' VAL . 2.8 m-85 -59.13 -62.33 1.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.91 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.459 ' O ' ' N ' ' A' ' 78' ' ' ASN . 8.1 tp-100 -67.84 -28.86 67.91 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.65 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.638 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.51 -40.53 5.69 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 110.28 179.7 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' CG2' ' A' ' 16' ' ' VAL . 1.7 t80 -72.05 -53.99 11.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.277 178.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.501 HD21 ' CB ' ' A' ' 13' ' ' LEU . 5.7 mt -54.75 -33.81 61.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.459 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.4 m-20 -74.41 -49.85 20.9 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.38 178.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.891 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 7.3 mp -65.03 -58.29 6.46 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.721 -179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.568 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -65.91 -46.68 87.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 O-C-N 123.351 0.407 . . . . 0.0 111.259 179.481 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.486 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -55.72 -50.43 60.83 Favored Glycine 0 CA--C 1.506 -0.488 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.61 -29.89 54.96 Favored Glycine 0 CA--C 1.523 0.54 0 C-N-CA 120.411 -0.9 . . . . 0.0 111.663 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 1.032 HD21 ' HG3' ' A' ' 59' ' ' MET . 24.6 mt -66.57 -47.32 73.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.075 0.464 . . . . 0.0 110.198 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.21 -34.71 64.16 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.801 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.498 HG11 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.08 -17.56 9.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.31 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.06 16.61 16.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.358 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' A' ' 83' ' ' LEU . 22.6 t -163.55 -30.85 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.587 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 57.2 t60 -84.5 51.73 2.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.817 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.64 32.6 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -94.17 -67.03 0.88 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.486 179.623 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.19 -35.96 7.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.337 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.451 HG21 ' HA ' ' A' ' 87' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.878 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.689 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.356 0.598 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.84 -47.73 11.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.027 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.908 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.9 OUTLIER -63.44 -39.13 93.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.247 179.221 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.689 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.6 OUTLIER -52.39 -34.24 47.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.705 179.867 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.42 -39.58 32.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.987 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.8 p -58.64 -42.51 88.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.372 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -67.57 -56.05 14.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.819 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.979 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.9 -27.23 12.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.564 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.5 m -71.75 -55.67 7.2 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.942 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -63.68 -28.36 69.84 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.105 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -70.73 -36.96 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.562 0.696 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.54 -33.08 58.57 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.233 -176.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.942 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.7 m -53.23 -38.86 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.58 ' CD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -75.24 -57.75 3.71 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.58 179.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.1 mm100 -48.96 -30.38 5.91 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -52.29 65.96 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.101 -178.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.852 ' HB3' HD21 ' B' ' 30' ' ' LEU . 17.4 m-85 -81.04 -47.89 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.767 0.794 . . . . 0.0 109.873 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.87 -25.08 55.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.632 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.389 -179.842 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.641 0.258 . . . . 0.0 111.579 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.412 HG22 ' O ' ' B' ' 71' ' ' LEU . 16.6 p -139.3 178.77 6.95 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.141 0.496 . . . . 0.0 111.166 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.852 HD21 ' HB3' ' B' ' 20' ' ' TYR . 1.3 tt -125.29 -115.34 0.28 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.951 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.51 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 43.4 t 176.01 129.16 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.444 ' HB3' ' HE2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.7 -35.79 23.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.914 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.733 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.07 -44.2 54.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.886 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.7 OUTLIER -58.57 -28.78 65.86 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.094 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -70.38 -28.09 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.964 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.733 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.51 -58.89 6.07 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.714 0.769 . . . . 0.0 111.057 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.968 ' O ' HG22 ' B' ' 41' ' ' THR . 3.2 m -56.13 -44.18 78.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.421 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.438 ' HE1' HG21 ' A' ' 6' ' ' THR . 10.2 t80 -57.47 -29.14 64.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.899 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -76.5 -41.34 47.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.692 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -73.61 -19.49 60.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.221 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.968 HG22 ' O ' ' B' ' 37' ' ' SER . 0.6 OUTLIER -98.22 -66.93 0.87 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -177.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.6 ' H ' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -96.23 -20.92 18.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 -176.292 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.588 HD21 HD11 ' A' ' 10' ' ' ILE . 31.6 mt -120.57 45.78 2.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.618 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.75 -32.14 35.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.998 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.51 -23.67 51.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.754 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -90.35 -8.52 50.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.18 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.43 ' CG2' ' HG2' ' B' ' 39' ' ' MET . 6.6 p . . . . . 0 C--N 1.333 -0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.024 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 120.787 0.327 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' ' HG2' ' B' ' 59' ' ' MET . 0.2 OUTLIER -64.46 -50.28 68.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.84 -45.2 78.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -25.23 62.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.95 0.405 . . . . 0.0 111.024 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' MET . . . . . 1.069 ' HG3' HD21 ' B' ' 83' ' ' LEU . 9.5 mmm -65.65 -54.62 25.13 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.497 0.665 . . . . 0.0 112.021 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.667 ' HA ' ' HE3' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.2 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.436 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.933 0.397 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.585 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.4 OUTLIER -69.66 -140.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.6 OUTLIER 173.36 169.86 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.933 0.396 . . . . 0.0 111.044 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.498 ' HB2' HG11 ' A' ' 85' ' ' VAL . 2.8 m-85 -59.16 -62.32 1.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.86 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' B' ' 78' ' ' ASN . 8.1 tp-100 -67.97 -28.75 67.72 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.625 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.623 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.54 -40.52 5.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 110.201 179.688 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.462 ' CE1' ' CG2' ' B' ' 16' ' ' VAL . 1.7 t80 -72.05 -54.04 11.05 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.294 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.506 HD21 ' CB ' ' B' ' 13' ' ' LEU . 5.7 mt -54.68 -33.84 61.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.402 0.62 . . . . 0.0 109.516 178.157 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.4 m-20 -74.44 -49.85 20.78 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.33 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.906 ' HG ' ' HB3' ' B' ' 59' ' ' MET . 7.2 mp -65.01 -58.31 6.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.732 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.564 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -65.97 -46.55 87.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 O-C-N 123.386 0.429 . . . . 0.0 111.283 179.524 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.496 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -55.72 -50.47 60.61 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.45 -30.03 54.68 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.467 -0.873 . . . . 0.0 111.69 177.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 1.069 HD21 ' HG3' ' B' ' 59' ' ' MET . 24.7 mt -66.69 -47.22 73.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.043 0.449 . . . . 0.0 110.177 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.572 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.24 -34.81 64.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.689 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.509 HG11 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.03 -17.48 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.364 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.09 16.56 16.0 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.244 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' B' ' 83' ' ' LEU . 22.8 t -163.53 -30.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.572 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 57.1 t60 -84.48 51.72 2.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.831 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.62 32.57 0.06 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 0.4 OUTLIER -94.09 -67.04 0.88 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 110.486 179.645 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.15 -36.05 7.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.389 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.442 HG21 ' CA ' ' B' ' 87' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.957 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.565 HG23 ' H ' ' A' ' 7' ' ' GLU . 10.1 t . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 121.67 0.748 . . . . 0.0 111.263 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.9 -48.04 11.24 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.868 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.824 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.9 m -67.11 -34.42 77.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.736 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.565 ' H ' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.91 -45.98 64.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.882 0.373 . . . . 0.0 110.579 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -26.81 66.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.401 178.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.449 ' CB ' ' HB3' ' B' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.678 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.022 HG12 HD11 ' B' ' 80' ' ' ILE . 1.6 mp -48.9 -56.11 2.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.877 0.37 . . . . 0.0 111.652 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.958 ' HA ' HD12 ' A' ' 14' ' ' ILE . 5.2 mt-10 -51.85 -27.19 11.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.722 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.4 m -62.09 -55.9 24.26 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.011 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -76.04 -27.83 57.46 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.018 HD11 HG22 ' A' ' 10' ' ' ILE . 7.2 mt -67.15 -37.3 78.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.489 0.662 . . . . 0.0 111.008 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.92 -32.59 57.48 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.565 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.011 HG22 ' O ' ' A' ' 13' ' ' LEU . 22.1 m -52.02 -38.2 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.482 ' N ' HG23 ' A' ' 16' ' ' VAL . 7.6 t80 -77.4 -58.42 3.29 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.244 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.805 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.7 mm-40 -49.12 -25.61 2.25 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.3 -52.74 36.84 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.916 -178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.908 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.1 m-85 -81.6 -39.47 24.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.828 0.823 . . . . 0.0 109.894 178.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.558 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -70.6 -27.82 64.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.853 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.567 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.422 HG13 ' N ' ' A' ' 29' ' ' THR . 12.2 p . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.695 0.283 . . . . 0.0 111.48 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HA ' ' A' ' 72' ' ' ASP . 2.5 p -134.93 154.76 51.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.908 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -111.05 -136.39 0.37 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.918 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.476 ' H ' HD22 ' A' ' 30' ' ' LEU . 6.5 t -168.01 133.84 1.94 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.771 0.32 . . . . 0.0 110.539 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.86 -39.97 40.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.739 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -69.17 -46.63 67.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.424 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.74 65.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.033 0.444 . . . . 0.0 110.287 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -69.31 -29.4 67.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.111 179.012 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.739 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -51.73 -59.06 4.73 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.636 0.731 . . . . 0.0 111.297 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -47.23 81.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.57 -1.195 . . . . 0.0 111.386 -178.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 42' ' ' GLU . 10.8 t80 -57.73 -51.07 71.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.673 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.439 ' HE3' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.551 179.76 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.75 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 89.3 m-20 -73.53 -19.84 60.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.881 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -118.97 -80.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.107 0.479 . . . . 0.0 111.501 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 38' ' ' PHE . 2.2 mm-40 -46.0 -38.58 7.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.027 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.84 HD21 HD11 ' B' ' 10' ' ' ILE . 23.3 mt -130.69 50.8 2.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.937 0.399 . . . . 0.0 110.679 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.75 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -80.78 -35.19 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.099 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.98 -25.06 57.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.162 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.454 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 43.6 m-85 -91.97 15.09 13.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.423 HG21 ' CG ' ' A' ' 39' ' ' MET . 26.3 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.492 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.617 HG22 ' O ' ' A' ' 86' ' ' ALA . 40.8 t . . . . . 0 CA--C 1.526 0.052 0 CA-C-O 120.766 0.317 . . . . 0.0 111.404 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.826 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -67.81 -51.68 45.85 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.152 0.501 . . . . 0.0 110.488 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.826 ' N ' HD23 ' A' ' 56' ' ' LEU . 1.7 t0 -55.11 -26.83 40.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.905 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.588 HH21 ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -61.97 -47.26 85.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.682 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.842 ' CE ' HD21 ' A' ' 83' ' ' LEU . 5.1 ptp -69.31 -53.78 17.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.642 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.0 mtm . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.507 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 4.2 mm100 . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.699 0.285 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.698 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -64.49 -132.79 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.663 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.509 ' HA ' HG22 ' A' ' 29' ' ' THR . 2.3 t0 176.71 -171.37 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.81 0.732 . . . . 0.0 111.444 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.801 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.4 p90 -77.6 -54.87 5.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.489 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.478 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -77.63 -30.36 52.19 Favored 'General case' 0 CA--C 1.515 -0.37 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.326 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.726 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -44.83 -33.1 1.8 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -80.44 -54.4 5.73 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.847 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' B' ' 77' ' ' LEU . 6.9 mt -55.98 -33.37 64.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.408 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.14 -39.68 54.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.135 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.842 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.7 mp -64.56 -57.77 8.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.748 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.038 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.82 -43.71 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.139 179.427 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.71 -50.31 49.93 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.005 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.49 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.71 -35.52 38.57 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.359 -0.924 . . . . 0.0 111.427 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.842 HD21 ' CE ' ' A' ' 59' ' ' MET . 8.4 mt -62.19 -46.07 90.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.921 0.391 . . . . 0.0 110.098 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.32 -35.42 65.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 110.849 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.812 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -81.09 -17.15 12.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.115 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HG13 ' A' ' 92' ' ' VAL . . . -117.35 15.72 14.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.552 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -160.99 -27.43 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -179.443 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.525 ' HB2' ' O ' ' A' ' 84' ' ' ALA . 14.2 m-70 -93.79 27.56 2.68 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.611 -0.436 . . . . 0.0 112.159 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.783 ' HA ' HG23 ' A' ' 92' ' ' VAL . 1.4 mp0 59.34 16.51 5.11 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -72.94 -50.7 21.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.949 0.404 . . . . 0.0 109.95 179.334 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -113.03 -38.75 4.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.779 178.775 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.783 HG23 ' HA ' ' A' ' 89' ' ' GLU . 1.6 m . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.087 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.571 HG23 ' H ' ' B' ' 7' ' ' GLU . 10.1 t . . . . . 0 CA--C 1.517 -0.298 0 CA-C-O 121.625 0.726 . . . . 0.0 111.328 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.88 -48.14 11.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.801 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.801 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.8 m -67.06 -34.33 77.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.762 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.571 ' H ' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.99 -45.95 64.68 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.534 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -26.8 66.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.448 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.09 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.655 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.055 HG22 HD11 ' B' ' 14' ' ' ILE . 1.6 mp -48.94 -56.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.543 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 5.3 mt-10 -51.77 -27.27 11.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.7 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.3 m -62.07 -55.83 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 1.017 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -76.17 -27.75 57.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.055 HD11 HG22 ' B' ' 10' ' ' ILE . 7.1 mt -67.19 -37.27 78.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 O-C-N 121.558 -0.714 . . . . 0.0 110.964 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.99 -32.63 57.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.469 -1.241 . . . . 0.0 112.539 -176.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 1.017 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.0 m -52.05 -38.17 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.156 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' B' ' 16' ' ' VAL . 7.5 t80 -77.46 -58.38 3.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.155 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.7 mm-40 -49.17 -25.65 2.33 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.13 -52.83 36.83 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.891 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.929 ' HB3' HD21 ' B' ' 30' ' ' LEU . 8.1 m-85 -81.63 -39.44 24.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.808 0.813 . . . . 0.0 109.864 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.569 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -70.64 -27.83 64.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.816 -179.153 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.629 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.42 HG13 ' N ' ' B' ' 29' ' ' THR . 12.0 p . . . . . 0 CA--C 1.528 0.112 0 CA-C-O 120.709 0.29 . . . . 0.0 111.472 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.525 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 2.4 p -135.05 154.85 51.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.535 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.929 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -111.02 -136.37 0.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.015 179.817 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.474 ' H ' HD22 ' B' ' 30' ' ' LEU . 6.5 t -167.98 133.82 1.95 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.756 0.312 . . . . 0.0 110.577 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -39.97 40.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.96 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -69.2 -46.65 66.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.58 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.419 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.76 65.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.953 0.406 . . . . 0.0 110.195 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.763 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -69.25 -29.51 67.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.069 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.61 -59.02 4.74 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.664 0.745 . . . . 0.0 111.371 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.42 -47.16 82.49 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.346 -178.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' B' ' 42' ' ' GLU . 10.9 t80 -57.76 -51.07 71.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.65 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.456 ' HE3' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -63.29 -30.93 71.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.547 179.699 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.735 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 89.3 m-20 -73.48 -19.8 60.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.843 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -119.02 -80.38 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 0.0 111.491 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.444 ' HB2' ' CE1' ' B' ' 38' ' ' PHE . 2.1 mm-40 -46.03 -38.56 8.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.031 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 10' ' ' ILE . 23.4 mt -130.77 50.81 2.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.982 0.42 . . . . 0.0 110.662 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -80.77 -35.21 33.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.068 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.05 -24.99 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.175 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 43.9 m-85 -91.87 14.96 14.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.133 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.419 HG21 ' CG ' ' B' ' 39' ' ' MET . 26.3 p . . . . . 0 C--N 1.331 -0.208 0 CA-C-O 120.95 0.405 . . . . 0.0 110.445 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.623 HG22 ' O ' ' B' ' 86' ' ' ALA . 41.0 t . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.741 0.305 . . . . 0.0 111.314 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.835 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.2 OUTLIER -67.77 -51.71 45.72 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.216 0.532 . . . . 0.0 110.536 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.835 ' N ' HD23 ' B' ' 56' ' ' LEU . 1.7 t0 -55.09 -26.87 40.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.881 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' ARG . . . . . 0.59 HH21 ' HB2' ' B' ' 86' ' ' ALA . 0.2 OUTLIER -61.91 -47.19 86.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.708 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.854 ' CE ' HD21 ' B' ' 83' ' ' LEU . 5.1 ptp -69.44 -53.81 17.48 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.908 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.655 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.0 mtm . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.776 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.525 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 4.1 mm100 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.762 0.315 . . . . 0.0 111.386 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.702 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -64.48 -132.81 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.489 ' HA ' HG22 ' B' ' 29' ' ' THR . 2.3 t0 176.67 -171.37 0.08 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.798 0.727 . . . . 0.0 111.409 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.812 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.4 p90 -77.65 -54.96 5.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.433 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -77.57 -30.38 52.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.319 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.72 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.79 -33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.858 0.361 . . . . 0.0 110.155 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.595 ' HD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -80.32 -54.42 5.74 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.882 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' A' ' 77' ' ' LEU . 6.9 mt -55.95 -33.37 64.7 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.412 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.12 -39.8 54.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.101 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.853 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.7 mp -64.36 -57.92 7.97 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.773 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 1.022 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.75 -43.77 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.137 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.69 -50.27 49.97 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.316 -0.945 . . . . 0.0 111.068 179.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.8 -35.45 39.06 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.394 178.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.854 HD21 ' CE ' ' B' ' 59' ' ' MET . 8.6 mt -62.29 -46.06 90.48 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.896 0.379 . . . . 0.0 110.048 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.52 ' O ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.42 -35.3 65.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.329 0.585 . . . . 0.0 110.812 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.801 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -81.08 -17.25 12.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.159 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.683 ' HA ' HG13 ' B' ' 92' ' ' VAL . . . -117.31 15.72 14.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.534 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.411 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.3 OUTLIER -160.98 -27.37 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.52 ' HB2' ' O ' ' B' ' 84' ' ' ALA . 14.1 m-70 -93.92 27.67 2.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.547 -0.461 . . . . 0.0 112.121 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.763 ' HA ' HG23 ' B' ' 92' ' ' VAL . 1.4 mp0 59.31 16.52 5.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.431 ' CB ' ' HA ' ' B' ' 85' ' ' VAL . 0.2 OUTLIER -72.88 -50.75 21.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.971 0.415 . . . . 0.0 109.931 179.359 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.712 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -113.06 -38.69 4.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.789 178.841 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.763 HG23 ' HA ' ' B' ' 89' ' ' GLU . 1.6 m . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.156 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.473 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 0.0 111.189 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.82 -49.06 10.97 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.421 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.939 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.25 -41.56 96.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.093 0.473 . . . . 0.0 110.194 179.207 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.473 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.0 OUTLIER -51.44 -31.61 23.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -28.31 41.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.928 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 4.3 p -73.95 -40.66 62.89 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.391 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 14' ' ' ILE . 2.5 mp -66.92 -56.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.902 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -52.18 -27.33 14.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.428 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.581 ' O ' HG13 ' A' ' 16' ' ' VAL . 5.9 m -72.19 -56.03 6.24 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -178.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.837 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -64.9 -27.5 68.9 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.077 HD11 HG22 ' A' ' 10' ' ' ILE . 12.8 mt -69.06 -37.35 76.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 CA-C-O 121.491 0.662 . . . . 0.0 110.611 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.465 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -76.49 -39.69 52.41 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 114.027 -1.442 . . . . 0.0 112.402 -176.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 13' ' ' LEU . 20.2 m -50.96 -33.89 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 1.3 t80 -80.55 -59.01 2.85 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.222 -1.354 . . . . 0.0 113.249 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.67 -24.73 62.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -177.4 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -51.61 62.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.817 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.565 ' HB3' ' CE2' ' A' ' 38' ' ' PHE . 7.1 m-85 -80.83 -40.89 24.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.889 0.852 . . . . 0.0 109.564 177.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -62.58 -12.97 26.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.285 -179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.381 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.463 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.0 p . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.942 0.401 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.543 HG22 ' HA ' ' A' ' 72' ' ' ASP . 9.3 p -148.23 -179.38 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.692 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -138.97 -161.12 1.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.953 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.622 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -136.66 132.37 34.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.691 0.281 . . . . 0.0 110.398 178.781 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -40.64 41.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.512 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.713 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.17 -41.45 61.46 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.534 179.413 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 2.0 mt-10 -58.91 -32.36 69.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.079 0.466 . . . . 0.0 109.782 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.719 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -69.09 -26.88 65.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.385 179.295 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.713 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.61 -59.2 5.18 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.613 0.721 . . . . 0.0 111.191 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.452 ' O ' HG22 ' A' ' 41' ' ' THR . 14.6 m -60.16 -45.14 94.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.204 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.63 ' HE2' HD11 ' A' ' 30' ' ' LEU . 2.6 m-30 -57.8 -26.71 62.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.608 ' HG2' HG21 ' A' ' 47' ' ' THR . 2.7 ttm -78.24 -56.12 4.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.89 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -57.55 -19.69 27.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.025 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.959 HG23 ' HG2' ' A' ' 42' ' ' GLU . 10.8 t -96.68 -30.76 13.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.959 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -127.46 -37.5 2.0 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -177.551 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' B' ' 10' ' ' ILE . 7.9 mt -106.85 35.25 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.24 0.543 . . . . 0.0 110.256 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -77.11 -28.61 54.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.745 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.15 -27.46 33.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.74 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CZ ' ' CD2' ' A' ' 88' ' ' HIS . 3.5 m-85 -86.46 -28.23 23.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.591 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.608 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.7 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.212 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' ' 86' ' ' ALA . 53.3 t . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.871 0.367 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 56' ' ' LEU . 6.6 tt -66.82 -51.96 49.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.664 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -26.85 47.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.036 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.9 -52.95 63.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.915 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.879 ' CE ' HD21 ' A' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.54 55.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.915 0.388 . . . . 0.0 111.002 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.527 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.518 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.481 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 6.3 mm100 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.753 0.311 . . . . 0.0 111.423 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -64.6 -133.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.543 ' HA ' HG22 ' A' ' 29' ' ' THR . 1.7 t0 175.46 -169.51 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 118.801 0.728 . . . . 0.0 111.49 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.831 ' CD2' HG21 ' B' ' 85' ' ' VAL . 38.4 p90 -73.69 -58.86 3.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.469 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.482 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.05 -25.49 40.11 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.175 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.879 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -44.88 -32.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.378 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 t80 -80.12 -54.07 6.11 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.572 178.071 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' B' ' 77' ' ' LEU . 7.1 mt -56.97 -33.52 67.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.979 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.09 -42.01 57.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.786 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.2 mp -65.92 -57.3 8.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.132 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.888 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.13 -44.5 64.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.948 179.316 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.73 -50.24 50.36 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.145 -1.026 . . . . 0.0 110.731 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.63 -40.1 47.28 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.362 -0.923 . . . . 0.0 111.551 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.879 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.9 mt -59.17 -46.36 88.6 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.892 0.377 . . . . 0.0 110.353 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.725 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.5 -33.65 63.92 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 111.291 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -82.65 -17.07 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.282 -179.476 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.828 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -116.78 11.86 14.65 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.878 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.433 ' N ' HG22 ' A' ' 92' ' ' VAL . 18.6 t -152.75 -39.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.0 OUTLIER -89.82 -85.27 0.21 Allowed 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.82 -179.178 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -133.15 177.19 7.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.734 0.302 . . . . 0.0 111.079 -179.395 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 70.7 m 60.9 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.631 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 76.25 -49.45 0.59 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.247 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.433 HG22 ' N ' ' A' ' 87' ' ' CYS . 35.9 t . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 121.078 0.466 . . . . 0.0 111.575 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.461 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 121.572 0.701 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.85 -49.06 11.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.415 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.934 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.22 -41.67 96.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 110.128 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.0 OUTLIER -51.47 -31.44 23.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.695 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -28.31 40.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.588 ' HB2' HD22 ' A' ' 13' ' ' LEU . 4.3 p -73.95 -40.64 62.91 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.421 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.137 HG22 HD11 ' B' ' 14' ' ' ILE . 2.5 mp -66.77 -56.31 14.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.895 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.4 OUTLIER -52.13 -27.34 13.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.571 ' O ' HG13 ' B' ' 16' ' ' VAL . 5.9 m -72.12 -56.11 6.15 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.83 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -64.75 -27.69 69.07 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.137 HD11 HG22 ' B' ' 10' ' ' ILE . 13.0 mt -68.99 -37.42 77.2 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.78 0 CA-C-O 121.539 0.685 . . . . 0.0 110.608 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' ALA . . . . . 0.465 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -76.42 -39.66 52.92 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 113.962 -1.472 . . . . 0.0 112.442 -176.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.83 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.2 m -50.91 -33.97 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.509 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 1.3 t80 -80.5 -59.06 2.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 114.207 -1.36 . . . . 0.0 113.211 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.7 -24.73 62.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.378 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.38 -51.61 61.97 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.88 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.558 ' HB3' ' CE2' ' B' ' 38' ' ' PHE . 7.1 m-85 -80.78 -40.95 24.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.842 0.829 . . . . 0.0 109.564 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -62.58 -12.94 25.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.158 -1.383 . . . . 0.0 112.327 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.495 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.58 ' O ' HG13 ' B' ' 28' ' ' VAL . 10.9 p . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 121.007 0.432 . . . . 0.0 111.127 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.525 HG22 ' HA ' ' B' ' 72' ' ' ASP . 9.5 p -148.18 -179.42 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.906 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.688 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -138.95 -161.07 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.019 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.625 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -136.68 132.32 34.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.783 0.325 . . . . 0.0 110.359 178.809 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.65 -40.71 40.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.951 0.405 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.715 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.06 -41.53 61.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.538 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' B' ' 38' ' ' PHE . 2.0 mt-10 -58.96 -32.36 69.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 109.786 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.705 ' HD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -69.07 -26.81 65.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.446 179.237 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.6 -59.26 5.09 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.455 ' O ' HG22 ' B' ' 41' ' ' THR . 14.6 m -60.04 -45.19 93.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.206 -178.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.638 ' HE2' HD11 ' B' ' 30' ' ' LEU . 2.5 m-30 -57.8 -26.75 62.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.973 0.416 . . . . 0.0 110.729 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.619 ' HG2' HG21 ' B' ' 47' ' ' THR . 2.7 ttm -78.22 -56.15 4.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.916 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -57.58 -19.61 26.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.071 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.978 HG23 ' HG2' ' B' ' 42' ' ' GLU . 10.7 t -96.73 -30.81 13.0 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.978 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -127.38 -37.46 2.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.587 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 10' ' ' ILE . 7.9 mt -106.93 35.41 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.268 0.556 . . . . 0.0 110.234 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -77.18 -28.6 54.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.777 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.11 -27.5 33.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.76 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.423 ' CZ ' ' CD2' ' B' ' 88' ' ' HIS . 3.5 m-85 -86.41 -28.31 23.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.659 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.619 HG21 ' HG2' ' B' ' 39' ' ' MET . 29.7 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.142 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.827 HG22 ' HB1' ' B' ' 86' ' ' ALA . 53.7 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.881 0.372 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.676 HD23 ' C ' ' B' ' 56' ' ' LEU . 6.6 tt -66.72 -51.98 49.74 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.662 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -26.82 47.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.069 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.83 -52.94 63.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.978 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.906 ' HE2' HD21 ' B' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.52 55.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.027 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.524 ' N ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.567 -179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.502 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 6.3 mm100 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.683 0.278 . . . . 0.0 111.407 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.861 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -64.46 -133.62 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.525 ' HA ' HG22 ' B' ' 29' ' ' THR . 1.7 t0 175.43 -169.55 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 118.805 0.73 . . . . 0.0 111.458 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 38.6 p90 -73.61 -58.88 3.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.509 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.06 -25.5 40.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.104 179.408 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.861 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.2 OUTLIER -44.93 -32.63 1.68 Allowed 'General case' 0 CA--C 1.522 -0.115 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.438 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.565 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 t80 -80.2 -54.01 6.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.555 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' A' ' 77' ' ' LEU . 7.1 mt -56.97 -33.63 67.27 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.902 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.95 -42.07 58.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.792 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.2 mp -65.95 -57.2 8.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.129 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.896 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.21 -44.57 64.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.923 179.353 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.6 -50.3 49.29 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.17 -1.014 . . . . 0.0 110.761 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.561 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.63 -40.07 47.23 Favored Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.231 -0.985 . . . . 0.0 111.618 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.906 HD21 ' HE2' ' B' ' 59' ' ' MET . 7.0 mt -59.16 -46.39 88.5 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.828 0.347 . . . . 0.0 110.264 178.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.717 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.44 -33.76 63.89 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.23 0.538 . . . . 0.0 111.209 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.831 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -82.64 -17.1 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.235 -179.351 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -116.85 11.97 14.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.863 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.435 ' N ' HG22 ' B' ' 92' ' ' VAL . 18.7 t -152.78 -39.46 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.103 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.0 OUTLIER -89.8 -85.24 0.21 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.856 -179.196 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' B' ' 85' ' ' VAL . 0.1 OUTLIER -133.04 177.22 7.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.749 0.309 . . . . 0.0 111.079 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' B' ' 91' ' ' PHE . 70.5 m 60.87 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.655 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' B' ' 90' ' ' SER . 0.1 OUTLIER 76.19 -49.48 0.59 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.226 -179.739 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.435 HG22 ' N ' ' B' ' 87' ' ' CYS . 36.0 t . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 121.288 0.566 . . . . 0.0 111.03 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.43 -44.24 8.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.321 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.863 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.3 m -71.63 -38.18 70.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.363 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.7 OUTLIER -52.49 -53.33 47.17 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.969 0.414 . . . . 0.0 110.445 179.772 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.08 -26.65 62.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.584 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.573 ' HB3' HD22 ' B' ' 13' ' ' LEU . 74.2 m -74.67 -54.42 7.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.569 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 2.2 mp -54.7 -56.5 10.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.847 0.356 . . . . 0.0 111.574 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.951 ' HA ' HD12 ' A' ' 14' ' ' ILE . 1.8 mt-10 -52.32 -27.46 15.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.847 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -62.88 -55.72 23.59 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.196 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.979 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -74.79 -27.83 60.47 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.354 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 6.6 mt -67.2 -35.93 75.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 O-C-N 121.648 -0.657 . . . . 0.0 110.925 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.94 -32.7 45.6 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.455 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.2 m -52.67 -35.83 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 176.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 3.1 t80 -78.02 -59.01 2.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.032 -1.44 . . . . 0.0 110.634 179.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.773 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 3.8 mm-40 -49.61 -45.69 48.38 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -47.91 -51.58 22.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.646 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.4 m-85 -81.17 -31.89 33.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.672 0.749 . . . . 0.0 110.289 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -86.72 20.13 2.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.0 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.303 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.612 0.244 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.49 HG22 ' HA ' ' A' ' 72' ' ' ASP . 3.3 p -140.69 153.13 45.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.137 0.494 . . . . 0.0 111.536 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.663 HD12 ' HE2' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.17 0.51 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.956 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.502 ' H ' HD13 ' A' ' 30' ' ' LEU . 14.0 t -145.25 138.05 26.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.758 0.314 . . . . 0.0 110.455 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.81 -35.85 24.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.813 -179.719 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.703 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.35 -42.85 58.68 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.441 179.484 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -55.92 -29.03 59.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 110.035 179.676 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.581 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -72.21 -32.56 66.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.057 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.703 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -50.02 -59.13 4.19 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.654 0.74 . . . . 0.0 110.913 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.734 ' O ' HG22 ' A' ' 41' ' ' THR . 0.2 OUTLIER -63.79 -44.27 93.87 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.7 -179.141 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 20' ' ' TYR . 32.0 t80 -58.01 -29.64 65.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.821 ' HG2' HG21 ' A' ' 47' ' ' THR . 1.1 ttm -78.08 -46.61 20.34 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.47 -19.74 63.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.028 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.816 HG23 ' HG2' ' A' ' 42' ' ' GLU . 5.9 t -94.35 -35.44 12.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.816 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -128.78 20.23 6.03 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.724 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.5 HD21 HD11 ' B' ' 10' ' ' ILE . 13.7 mt -161.84 44.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.349 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.52 -23.93 56.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.87 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.68 -14.13 62.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.229 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.458 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.2 m-85 -110.97 11.08 22.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.355 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.821 HG21 ' HG2' ' A' ' 39' ' ' MET . 30.0 p . . . . . 0 C--N 1.331 -0.211 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 1.6 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.179 0.514 . . . . 0.0 110.844 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.02 -52.01 12.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.908 -179.457 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.817 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.4 t0 -56.45 -29.28 61.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.264 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -52.2 66.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.252 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.897 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.9 ptp -54.95 -52.85 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.927 0.394 . . . . 0.0 111.175 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.5 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.286 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.481 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.9 mm100 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.878 0.371 . . . . 0.0 111.376 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.896 HD13 ' HG2' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -66.41 -139.02 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.255 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.511 ' C ' ' OE1' ' A' ' 75' ' ' GLU . 4.4 p-10 172.48 -157.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.347 0.521 . . . . 0.0 111.777 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.809 ' CD2' HG21 ' B' ' 85' ' ' VAL . 29.7 p90 -84.46 -59.93 2.23 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.524 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 7.9 tp-100 -76.98 -35.13 57.42 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -177.435 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.896 ' HG2' HD13 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -49.22 -26.53 2.98 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.005 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.663 ' HE2' HD12 ' A' ' 30' ' ' LEU . 1.1 t80 -77.33 -54.05 6.94 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' B' ' 77' ' ' LEU . 8.0 mt -57.79 -33.56 68.69 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.68 -43.35 38.15 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.837 HD13 ' O ' ' A' ' 75' ' ' GLU . 2.7 mp -58.08 -57.57 12.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.782 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.962 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.93 -44.17 28.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.061 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.17 51.33 Favored Glycine 0 CA--C 1.508 -0.363 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.732 179.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.29 -41.13 46.89 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.147 -1.025 . . . . 0.0 111.394 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.897 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.6 mt -57.91 -46.8 84.42 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.623 -0.339 . . . . 0.0 110.466 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.441 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.57 -31.95 62.62 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.051 0.453 . . . . 0.0 111.058 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.818 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.17 -17.6 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.512 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -114.03 14.16 18.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.134 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.458 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -156.19 -37.72 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.347 179.636 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 12.7 t-80 -91.11 157.99 16.91 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.891 0.377 . . . . 0.0 111.081 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 93.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.052 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.3 m -150.29 -67.8 0.2 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.601 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.604 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -121.05 -32.54 3.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.01 179.722 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.454 HG13 ' HA ' ' A' ' 86' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.471 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.733 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.265 0 CA-C-O 121.36 0.6 . . . . 0.0 110.964 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.45 -44.22 8.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.376 -179.191 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.851 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.6 m -71.75 -38.03 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.35 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.733 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.7 OUTLIER -52.45 -53.36 46.52 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.915 0.388 . . . . 0.0 110.461 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.12 -26.66 62.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.574 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 13' ' ' LEU . 74.2 m -74.59 -54.41 7.52 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.604 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.078 HG22 HD11 ' B' ' 14' ' ' ILE . 2.2 mp -54.72 -56.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 111.615 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.968 ' HA ' HD12 ' B' ' 14' ' ' ILE . 1.8 mt-10 -52.38 -27.34 15.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -63.02 -55.74 23.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.978 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -74.7 -27.83 60.56 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.078 HD11 HG22 ' B' ' 10' ' ' ILE . 6.7 mt -67.22 -35.93 75.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 121.612 -0.68 . . . . 0.0 110.859 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.09 -32.6 44.74 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.459 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.978 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.2 m -52.57 -35.97 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 176.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.566 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.1 t80 -77.92 -59.03 2.95 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 113.923 -1.489 . . . . 0.0 110.683 179.224 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 3.8 mm-40 -49.68 -45.65 49.02 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -47.79 -51.72 21.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.614 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.525 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.4 m-85 -81.11 -31.91 34.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.627 0.727 . . . . 0.0 110.294 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.485 ' HA ' HD23 ' B' ' 30' ' ' LEU . . . -86.74 20.12 2.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.931 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.421 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.324 179.925 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.633 0.254 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.486 HG22 ' HA ' ' B' ' 72' ' ' ASP . 3.3 p -140.69 153.19 45.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.291 0.567 . . . . 0.0 111.417 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.661 HD12 ' HE2' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.19 0.51 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.956 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.494 ' H ' HD13 ' B' ' 30' ' ' LEU . 13.9 t -145.28 138.03 26.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.306 . . . . 0.0 110.462 179.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.77 -35.92 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.776 -179.694 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.702 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.22 -42.94 58.95 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.456 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.1 OUTLIER -55.94 -28.96 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.059 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.569 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -72.26 -32.61 66.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.028 178.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -49.96 -59.07 4.23 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.594 0.712 . . . . 0.0 110.863 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.755 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -63.97 -44.09 93.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.631 -178.965 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.449 ' HB2' ' CZ ' ' B' ' 20' ' ' TYR . 31.9 t80 -58.16 -29.65 65.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.831 ' HG2' HG21 ' B' ' 47' ' ' THR . 1.1 ttm -78.03 -46.64 20.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.946 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.51 -19.63 63.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.082 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.811 HG23 ' HG2' ' B' ' 42' ' ' GLU . 5.9 t -94.45 -35.32 12.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.811 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.1 OUTLIER -128.86 20.3 5.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.804 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.482 HD21 HD11 ' A' ' 10' ' ' ILE . 13.7 mt -161.85 44.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.036 0.446 . . . . 0.0 110.413 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.44 -24.09 57.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.814 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.67 -13.98 62.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.246 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.1 m-85 -111.03 11.12 22.09 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.419 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.831 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.641 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 1.6 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.154 0.502 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.807 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.03 -51.91 12.39 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.944 -179.434 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.807 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.4 t0 -56.56 -29.27 61.81 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.282 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -52.19 66.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.245 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.938 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.9 ptp -54.89 -52.9 61.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 111.236 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.493 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.36 -179.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.471 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.8 mm100 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.97 0.414 . . . . 0.0 111.324 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.847 HD13 ' HG2' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -66.36 -139.02 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.212 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.504 ' C ' ' OE1' ' B' ' 75' ' ' GLU . 4.4 p-10 172.47 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.383 0.538 . . . . 0.0 111.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CG ' HG11 ' A' ' 85' ' ' VAL . 29.7 p90 -84.45 -59.92 2.23 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -178.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.51 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 7.9 tp-100 -76.94 -35.11 57.51 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.847 ' HG2' HD13 ' B' ' 71' ' ' LEU . 0.8 OUTLIER -49.25 -26.63 3.11 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.925 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.661 ' HE2' HD12 ' B' ' 30' ' ' LEU . 1.1 t80 -77.25 -54.08 6.93 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' A' ' 77' ' ' LEU . 8.0 mt -57.77 -33.51 68.58 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -76.71 -43.35 37.88 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.829 HD13 ' O ' ' B' ' 75' ' ' GLU . 2.7 mp -58.2 -57.46 12.78 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.796 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 1.0 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.92 -44.18 28.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.09 179.406 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -50.11 51.66 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.178 -1.01 . . . . 0.0 110.747 179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.32 -41.16 47.18 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.375 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.938 HD21 ' HE2' ' B' ' 59' ' ' MET . 6.4 mt -57.87 -46.85 84.23 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.438 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.47 -31.98 62.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.143 0.497 . . . . 0.0 111.205 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.809 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.15 -17.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.586 -179.469 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.641 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -113.96 14.01 18.37 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.162 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.448 ' HB3' ' CD2' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -156.12 -37.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.321 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.7 t-80 -91.02 157.98 16.95 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.879 0.371 . . . . 0.0 111.118 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.38 93.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.975 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.6 m -150.43 -67.69 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.612 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -121.11 -32.59 3.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.96 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.444 HG13 ' HA ' ' B' ' 86' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.53 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.77 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.184 0 CA-C-O 121.476 0.655 . . . . 0.0 111.702 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.48 -48.97 37.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.755 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.941 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.4 m -60.49 -37.57 81.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.078 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.77 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.7 -36.64 47.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.46 -26.96 41.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.342 178.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -65.37 -45.31 84.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.288 -179.714 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.134 HG22 HD11 ' A' ' 14' ' ' ILE . 3.2 mp -63.05 -56.77 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.46 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.72 -179.455 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.74 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.871 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.929 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -71.97 -27.22 62.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.134 HD11 HG22 ' A' ' 10' ' ' ILE . 7.8 mt -66.9 -36.02 76.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.944 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.75 -35.67 60.11 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.35 -1.296 . . . . 0.0 112.473 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.929 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.9 m -56.82 -35.68 47.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.479 0.657 . . . . 0.0 109.742 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 14.6 t80 -80.22 -59.91 2.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.757 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.905 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 3.9 pt20 -66.51 -29.63 69.77 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.335 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.43 -51.68 52.71 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.323 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.523 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.0 m-85 -80.35 -40.03 27.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.69 0.757 . . . . 0.0 109.538 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.905 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.89 -24.47 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.608 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.443 -179.921 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.458 -0.061 0 CA-C-O 120.912 0.386 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.718 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 20.8 p -136.4 -177.45 4.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.71 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -129.68 -128.24 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.632 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.631 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -170.97 130.47 0.79 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.409 ' CE ' ' HG2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.33 43.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.944 0.402 . . . . 0.0 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.695 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.33 -43.42 56.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.482 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.7 mt-10 -55.82 -29.15 59.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.01 0.433 . . . . 0.0 110.428 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.509 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 6.8 t80 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.371 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.695 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.76 -59.04 5.61 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.686 0.755 . . . . 0.0 111.3 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.891 ' O ' HG22 ' A' ' 41' ' ' THR . 0.7 OUTLIER -58.24 -32.52 68.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.274 -178.488 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -57.78 -38.18 75.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.696 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -74.61 -35.4 62.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.201 0.524 . . . . 0.0 110.338 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -73.27 -19.25 61.1 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.46 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 37' ' ' SER . 3.7 t -107.65 -43.57 4.47 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -178.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.62 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.2 mm-40 -127.85 -18.42 4.26 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -176.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 10' ' ' ILE . 9.4 mt -120.27 49.56 1.41 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.273 0.559 . . . . 0.0 110.183 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -82.93 -29.37 29.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.926 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.75 30.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.59 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 87' ' ' CYS . 47.8 m-85 -95.79 20.48 9.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.52 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.745 -179.934 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 86' ' ' ALA . 53.9 t . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.724 0.297 . . . . 0.0 111.392 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -76.51 -52.57 9.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.066 0.46 . . . . 0.0 112.017 -179.491 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.822 ' N ' HD23 ' A' ' 56' ' ' LEU . 10.2 t0 -55.38 -59.08 5.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.196 -178.114 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.8 -35.59 73.09 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.832 ' HE2' HD21 ' A' ' 83' ' ' LEU . 3.2 tmm? -75.51 -43.78 47.18 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 120.426 0.155 . . . . 0.0 111.413 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.483 ' HG3' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.856 0.36 . . . . 0.0 110.443 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.432 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 3.4 mm100 . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.697 0.284 . . . . 0.0 110.865 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -65.0 -137.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 22.9 t70 171.78 161.24 0.1 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.436 0.562 . . . . 0.0 111.492 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.941 ' CG ' HG11 ' B' ' 85' ' ' VAL . 35.9 p90 -52.14 -59.77 3.99 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.644 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.42 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -79.66 -22.9 42.94 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.261 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.942 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.4 tt0 -45.41 -43.68 11.45 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.6 t80 -71.32 -54.41 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.301 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.472 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -51.19 -38.56 52.99 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.183 0.516 . . . . 0.0 109.74 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.39 -36.72 57.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.494 -0.776 . . . . 0.0 108.991 178.028 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.27 -57.54 8.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.288 -179.514 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.89 -43.84 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 178.636 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.45 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -54.2 -50.99 53.68 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.65 179.179 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.58 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.05 -41.64 60.27 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.867 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.832 HD21 ' HE2' ' A' ' 59' ' ' MET . 3.3 mt -61.86 -42.26 98.84 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -54.42 -32.43 57.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.374 0.607 . . . . 0.0 110.188 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.932 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.67 -17.78 9.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.553 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.494 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.87 14.5 19.81 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.143 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 46' ' ' PHE . 52.8 t -157.94 -42.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.926 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.413 ' ND1' HD13 ' B' ' 14' ' ' ILE . 15.0 t-80 -90.31 162.93 14.95 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.872 0.368 . . . . 0.0 110.963 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.18 112.64 1.79 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.081 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.65 -53.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.808 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -127.39 -45.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.691 179.85 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.486 HG11 ' C ' ' A' ' 86' ' ' ALA . 30.8 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.761 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.37 -49.07 36.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.752 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.912 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.4 m -60.44 -37.55 81.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.089 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.761 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -36.69 48.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.008 0.432 . . . . 0.0 110.274 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -26.95 42.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.413 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.47 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.5 OUTLIER -65.44 -45.3 84.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.227 -179.664 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' B' ' 14' ' ' ILE . 3.2 mp -63.1 -56.75 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.434 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.702 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.508 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.86 13.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.795 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.928 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -71.92 -27.16 62.64 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' B' ' 10' ' ' ILE . 7.8 mt -66.92 -36.04 76.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 O-C-N 121.751 -0.593 . . . . 0.0 110.998 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.76 60.36 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 112.474 -176.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.928 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.1 m -56.85 -35.63 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.458 0.647 . . . . 0.0 109.748 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.511 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 14.8 t80 -80.16 -59.98 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.737 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 4.0 pt20 -66.44 -29.68 69.87 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.47 -51.68 52.96 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.318 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.52 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.0 m-85 -80.3 -39.99 27.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.708 0.766 . . . . 0.0 109.66 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.883 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -56.91 -24.41 52.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.623 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.459 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.403 HG13 ' N ' ' B' ' 29' ' ' THR . 13.9 p . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.913 0.387 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.722 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 20.6 p -136.4 -177.39 4.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.609 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.689 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -129.67 -128.24 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.61 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.624 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -170.96 130.5 0.79 Allowed 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.404 ' CE ' ' HG2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.31 43.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.017 -179.533 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.36 -43.33 57.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.997 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.474 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.7 mt-10 -55.99 -29.02 59.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.079 0.466 . . . . 0.0 110.425 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 6.9 t80 -72.77 -27.0 61.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.289 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.64 -59.02 5.62 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.597 0.713 . . . . 0.0 111.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.87 ' O ' HG22 ' B' ' 41' ' ' THR . 0.7 OUTLIER -58.23 -32.51 68.39 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.303 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.78 -38.2 75.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.693 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -74.65 -35.33 62.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.154 0.502 . . . . 0.0 110.326 179.459 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -73.28 -19.17 61.11 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.476 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.87 HG22 ' O ' ' B' ' 37' ' ' SER . 3.7 t -107.61 -43.71 4.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.2 mm-40 -127.76 -18.53 4.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -176.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.724 HD21 HD11 ' A' ' 10' ' ' ILE . 9.4 mt -120.14 49.51 1.4 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.312 0.577 . . . . 0.0 110.304 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -82.94 -29.3 29.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.919 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.74 30.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.57 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.415 ' CD1' ' HB3' ' B' ' 87' ' ' CYS . 47.4 m-85 -95.86 20.52 9.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.725 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.709 -179.915 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.486 HG13 ' HB3' ' B' ' 86' ' ' ALA . 54.2 t . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.7 0.286 . . . . 0.0 111.377 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.834 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -76.49 -52.59 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.056 0.455 . . . . 0.0 112.03 -179.532 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 57' ' ' ASP . . . . . 0.834 ' N ' HD23 ' B' ' 56' ' ' LEU . 10.2 t0 -55.34 -59.07 5.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.273 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.8 -35.68 73.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.838 ' HE2' HD21 ' B' ' 83' ' ' LEU . 3.2 tmm? -75.38 -43.88 47.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.436 0.16 . . . . 0.0 111.41 -179.579 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.481 ' HG3' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 120.858 0.361 . . . . 0.0 110.428 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 3.4 mm100 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.703 0.287 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -65.1 -138.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.591 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 22.8 t70 171.78 161.3 0.1 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.453 0.569 . . . . 0.0 111.462 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.932 ' CG ' HG11 ' A' ' 85' ' ' VAL . 35.6 p90 -52.16 -59.79 3.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.626 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.42 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -79.69 -22.91 42.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.16 -179.32 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.945 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.4 tt0 -45.42 -43.7 11.49 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.53 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.6 t80 -71.3 -54.39 10.99 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.356 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.47 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.3 mt -51.21 -38.65 53.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.195 0.521 . . . . 0.0 109.667 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.407 ' ND2' ' C ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -76.37 -36.58 58.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.049 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.945 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.36 -57.63 7.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.264 -179.564 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.71 -43.82 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.419 178.619 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.453 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -54.13 -51.0 53.35 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.141 -1.028 . . . . 0.0 110.705 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.582 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.07 -41.64 60.46 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.895 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.838 HD21 ' HE2' ' B' ' 59' ' ' MET . 3.4 mt -61.91 -42.28 98.91 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.27 -32.53 56.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.941 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.621 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.486 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.01 14.58 19.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.077 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.415 ' HB3' ' CD1' ' B' ' 46' ' ' PHE . 52.9 t -158.03 -42.27 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.404 ' ND1' HD13 ' A' ' 14' ' ' ILE . 14.8 t-80 -90.32 162.93 14.94 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.821 0.343 . . . . 0.0 110.972 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.21 112.61 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.67 -53.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.847 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -127.54 -45.58 1.48 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.711 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.479 HG11 ' C ' ' B' ' 86' ' ' ALA . 30.9 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 121.351 0.596 . . . . 0.0 111.156 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.96 -49.07 11.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.998 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.965 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.6 OUTLIER -62.55 -40.42 96.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.087 179.121 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.1 -36.64 41.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.633 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.67 -26.89 40.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.707 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.627 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.6 p -66.86 -42.2 86.08 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.513 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.04 HG22 HD11 ' A' ' 14' ' ' ILE . 3.5 mp -70.98 -54.65 16.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.776 0.322 . . . . 0.0 111.682 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.973 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.94 -27.28 12.63 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -178.606 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.622 ' O ' HG13 ' A' ' 16' ' ' VAL . 16.6 m -75.73 -55.87 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.777 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.808 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.8 mm? -58.82 -27.06 64.72 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.04 HD11 HG22 ' A' ' 10' ' ' ILE . 8.8 mt -73.54 -38.67 52.85 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 CA-C-O 121.489 0.661 . . . . 0.0 110.357 178.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 19' ' ' LYS . . . -73.63 -37.15 65.46 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.787 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -56.81 -36.29 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-O 121.463 0.649 . . . . 0.0 109.815 178.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.499 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 4.2 t80 -79.81 -59.92 2.55 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.664 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.9 pt20 -64.42 -39.45 93.86 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 11.7 tppt? -47.89 -50.69 25.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.812 0.339 . . . . 0.0 110.817 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -79.35 -39.83 31.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.769 0.795 . . . . 0.0 109.344 178.464 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.819 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.36 -19.02 43.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.24 -1.345 . . . . 0.0 112.063 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.627 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.433 ' O ' ' OG1' ' A' ' 29' ' ' THR . 28.5 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.789 0.328 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 28' ' ' VAL . 3.5 p 56.33 154.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.817 -0.628 . . . . 0.0 111.375 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.62 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -101.99 -128.9 0.23 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.27 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.472 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -171.81 123.79 0.53 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.391 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -49.68 -36.33 24.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.128 -179.244 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.21 -42.0 60.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.646 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.38 -28.59 68.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.114 0.483 . . . . 0.0 109.963 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -72.05 -31.62 66.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.958 179.166 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -50.87 -59.17 4.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.683 0.754 . . . . 0.0 111.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -55.18 28.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.446 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.51 ' CD2' ' CG ' ' A' ' 20' ' ' TYR . 21.2 m-85 -57.91 -35.6 71.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.166 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.622 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.1 OUTLIER -72.61 -27.6 62.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.602 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.802 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 6.2 m120 -73.71 -19.6 60.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.719 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.49 -80.74 0.58 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.669 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.39 -30.66 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.781 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.556 HD21 HD11 ' B' ' 10' ' ' ILE . 30.5 mt -133.64 51.67 2.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.004 0.43 . . . . 0.0 110.761 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.802 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -78.78 -41.49 30.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.884 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.87 24.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.245 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -82.6 -40.53 20.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.622 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.9 p . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.807 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 86' ' ' ALA . 34.6 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.771 0.32 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.61 ' O ' ' HG2' ' A' ' 59' ' ' MET . 10.8 tp -68.69 -45.11 72.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.557 0.694 . . . . 0.0 110.465 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.6 -26.51 44.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.846 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.14 -53.67 10.43 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.471 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.954 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -55.92 -53.79 52.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.004 0.431 . . . . 0.0 111.633 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.517 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.083 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 120.762 0.315 . . . . 0.0 110.488 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.737 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -70.39 -138.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.136 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.512 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.5 OUTLIER 172.39 179.04 0.08 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 118.516 0.598 . . . . 0.0 111.715 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.2 p90 -64.78 -57.65 8.35 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.336 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -78.81 -20.99 48.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.076 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -45.1 -36.86 3.87 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 35' ' ' PHE . 2.9 t80 -80.2 -54.24 5.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.799 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -51.83 -34.09 38.9 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.175 0.512 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.41 ' HB3' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.41 -48.99 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.223 178.009 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.834 HD13 ' O ' ' A' ' 75' ' ' GLU . 5.3 mp -59.78 -58.19 9.65 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.868 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.786 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -71.24 -46.46 65.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.843 179.576 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.552 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.84 -50.35 50.53 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.102 -1.047 . . . . 0.0 110.525 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.462 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -52.11 -32.79 36.29 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.583 178.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.954 HD21 ' HE3' ' A' ' 59' ' ' MET . 14.1 mt -64.48 -46.6 82.32 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 120.901 0.381 . . . . 0.0 110.12 179.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.571 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.09 -32.87 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.625 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.905 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.6 9.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.403 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.94 12.75 14.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.671 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.491 ' N ' ' O ' ' A' ' 83' ' ' LEU . 53.6 t -152.45 -43.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.879 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -84.11 148.82 26.59 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.75 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.36 85.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.213 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' PHE . 41.0 p -179.59 102.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.744 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.575 ' CB ' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 82.85 -30.13 0.09 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.8 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 85' ' ' VAL . 60.4 t . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.715 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.179 0 CA-C-O 121.478 0.656 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -49.11 11.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.998 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.977 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.6 OUTLIER -62.44 -40.44 96.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.025 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.16 -36.58 41.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.61 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.77 -26.88 40.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.66 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -66.79 -42.26 86.28 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.519 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 0.989 HG22 HD11 ' B' ' 14' ' ' ILE . 3.5 mp -71.04 -54.63 16.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.597 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.992 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.01 -27.27 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.529 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' B' ' 16' ' ' VAL . 16.6 m -75.67 -55.83 5.27 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.909 -0.317 . . . . 0.0 111.833 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 0.814 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -58.83 -27.17 64.85 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' B' ' 11' ' ' GLU . 8.8 mt -73.44 -38.73 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 CA-C-O 121.433 0.635 . . . . 0.0 110.34 178.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' B' ' 19' ' ' LYS . . . -73.62 -37.1 65.49 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.824 -177.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.814 HG22 ' O ' ' B' ' 13' ' ' LEU . 18.8 m -56.85 -36.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.429 0.633 . . . . 0.0 109.81 178.348 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.497 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 4.2 t80 -79.8 -60.03 2.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.661 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.9 pt20 -64.34 -39.48 93.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' B' ' 15' ' ' ALA . 11.7 tppt? -47.9 -50.68 25.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.852 0.358 . . . . 0.0 110.888 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.518 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -79.25 -39.88 31.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.8 0.81 . . . . 0.0 109.335 178.404 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.842 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.45 -19.04 44.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.985 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.411 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.663 -179.927 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 28' ' ' VAL . . . . . 0.407 ' O ' ' OG1' ' B' ' 29' ' ' THR . 28.8 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.701 0.286 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' B' ' 28' ' ' VAL . 3.7 p 56.39 154.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.392 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.591 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -102.02 -128.91 0.23 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.255 -179.846 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.479 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -171.76 123.83 0.54 Allowed 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.457 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.0 OUTLIER -49.64 -36.38 24.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.087 -179.207 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.16 -42.11 60.45 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.28 -28.69 68.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 109.925 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -71.95 -31.72 66.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.207 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -50.81 -59.26 4.29 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.588 0.709 . . . . 0.0 111.49 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -55.14 29.45 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.578 -1.192 . . . . 0.0 111.527 -178.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.517 ' CD2' ' CG ' ' B' ' 20' ' ' TYR . 21.1 m-85 -57.87 -35.65 71.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.146 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.614 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.1 OUTLIER -72.63 -27.61 62.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.541 179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.788 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 6.2 m120 -73.62 -19.7 60.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.7 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.37 -80.93 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.668 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.28 -30.6 3.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.848 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.553 HD21 HD11 ' A' ' 10' ' ' ILE . 30.3 mt -133.74 51.65 2.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.813 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.788 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -78.74 -41.53 30.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.835 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.8 23.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -82.73 -40.52 20.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.614 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 86' ' ' ALA . 34.1 t . . . . . 0 N--CA 1.462 0.13 0 CA-C-O 120.696 0.284 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.6 ' O ' ' HG2' ' B' ' 59' ' ' MET . 10.7 tp -68.66 -45.11 72.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.578 0.704 . . . . 0.0 110.502 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.49 -26.6 43.56 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.856 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.21 -53.65 10.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.387 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.958 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -55.9 -53.79 52.51 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.018 0.437 . . . . 0.0 111.6 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.538 ' HE3' ' HG ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.147 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.406 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.463 0.215 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.732 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -70.41 -138.16 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.209 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.5 OUTLIER 172.38 179.13 0.08 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.463 0.574 . . . . 0.0 111.746 179.723 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.905 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.9 p90 -64.75 -57.73 8.15 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.349 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -78.85 -20.91 48.47 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.027 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.827 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -45.04 -37.01 3.82 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.765 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 3.0 t80 -80.21 -54.16 6.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.792 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' A' ' 77' ' ' LEU . 7.3 mt -51.84 -34.04 38.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.194 0.521 . . . . 0.0 109.733 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.5 -48.98 17.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.172 178.034 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.827 HD13 ' O ' ' B' ' 75' ' ' GLU . 5.3 mp -59.8 -58.13 9.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.869 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.789 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -71.29 -46.42 65.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.84 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.78 -50.4 49.98 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.126 -1.035 . . . . 0.0 110.555 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.485 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -52.22 -32.69 36.89 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.6 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.958 HD21 ' HE3' ' B' ' 59' ' ' MET . 14.2 mt -64.47 -46.58 82.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.979 0.419 . . . . 0.0 110.134 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.593 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.14 -32.89 62.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.603 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.52 -17.65 9.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.497 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.92 12.94 14.84 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.67 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.494 ' N ' ' O ' ' B' ' 83' ' ' LEU . 53.6 t -152.55 -43.49 0.1 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.495 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.9 OUTLIER -84.22 148.83 26.51 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.764 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.39 85.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' B' ' 91' ' ' PHE . 40.8 p -179.52 102.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.571 ' CB ' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 83.01 -30.15 0.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.765 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 85' ' ' VAL . 60.3 t . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.915 0.388 . . . . 0.0 111.299 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.624 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.18 0 CA-C-O 121.375 0.607 . . . . 0.0 111.149 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.02 -40.1 6.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.117 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.956 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.7 m -70.16 -37.43 75.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.233 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.624 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.66 60.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.015 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -77.4 -26.82 52.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.608 ' HB3' HD22 ' B' ' 13' ' ' LEU . 81.8 m -72.29 -51.87 18.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 1.079 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -52.89 -56.24 8.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.6 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 1.031 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.3 OUTLIER -52.36 -27.51 15.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -178.846 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -66.01 -55.71 15.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.038 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -71.19 -27.69 63.69 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.079 HD11 HG22 ' A' ' 10' ' ' ILE . 7.7 mt -67.3 -37.45 79.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.546 0.688 . . . . 0.0 110.882 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.03 -32.88 61.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.376 -176.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.038 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.1 m -52.63 -38.21 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.489 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.6 t80 -77.5 -58.05 3.48 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.529 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.81 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 5.8 mm100 -49.13 -35.8 17.41 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.839 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.1 -52.26 59.19 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.294 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.844 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.8 m-85 -81.28 -47.36 13.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.771 0.796 . . . . 0.0 110.093 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.565 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.89 -21.06 26.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.867 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.401 179.904 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.987 0.423 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.9 p -133.99 172.75 12.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.297 0.57 . . . . 0.0 110.778 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.844 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -114.38 -144.76 0.39 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.527 ' H ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -160.63 138.11 9.38 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.531 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -41.53 44.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.101 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.735 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.91 -45.31 61.68 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.416 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 3.6 mt-10 -57.57 -28.95 64.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.156 0.503 . . . . 0.0 109.97 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.451 ' CE2' ' CB ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -67.49 -32.97 74.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.805 178.709 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.735 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -51.01 -59.2 4.41 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.515 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.613 ' O ' HG22 ' A' ' 41' ' ' THR . 68.8 m -54.09 -48.64 70.46 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.593 -178.459 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.527 ' HA ' HG22 ' A' ' 41' ' ' THR . 31.8 t80 -57.92 -27.42 63.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.893 0.377 . . . . 0.0 110.966 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.932 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -73.7 -58.25 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.196 -179.809 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.423 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 1.9 p30 -65.38 -19.36 65.91 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.948 HG23 ' HG2' ' A' ' 42' ' ' GLU . 13.3 t -96.08 -31.73 12.88 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.948 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -129.29 14.67 6.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.826 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.879 HD12 ' HE2' ' A' ' 39' ' ' MET . 40.2 mt -161.93 41.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 109.692 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -75.67 -26.24 57.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.86 -7.7 36.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.05 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -112.25 -13.84 13.42 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.621 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.932 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.2 p . . . . . 0 N--CA 1.465 0.294 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.774 HG12 HD22 ' A' ' 83' ' ' LEU . 32.6 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.916 0.389 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.625 ' O ' ' HG3' ' A' ' 59' ' ' MET . 7.0 tp -75.24 -29.54 60.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 111.703 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -76.12 -28.19 57.37 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.643 -178.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.24 -45.21 41.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.697 0.284 . . . . 0.0 111.554 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.886 ' HE2' HD21 ' A' ' 83' ' ' LEU . 0.9 OUTLIER -54.35 -54.32 42.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 112.077 -179.283 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.658 ' H ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.517 -179.14 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 3.6 mm100 . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.608 0.242 . . . . 0.0 110.768 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 72' ' ' ASP . 0.8 OUTLIER -66.43 -146.79 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.396 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.627 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 1.3 p30 170.79 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.221 0.534 . . . . 0.0 112.127 179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.8 ' CZ ' ' HB1' ' B' ' 84' ' ' ALA . 0.3 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.698 -178.739 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -66.41 -34.01 76.99 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.603 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.919 ' O ' HD23 ' A' ' 79' ' ' LEU . 1.9 tt0 -45.14 -47.09 12.25 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.806 0.336 . . . . 0.0 110.188 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.8 t80 -70.98 -46.45 62.31 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.412 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.702 HD13 ' HA3' ' B' ' 81' ' ' GLY . 7.2 mt -56.81 -40.14 75.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.44 -39.51 53.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.056 178.183 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -60.26 -58.22 9.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.526 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.637 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.15 -46.08 45.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.706 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.707 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -54.27 -50.33 56.49 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.405 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.41 -35.53 36.14 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.425 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.886 HD21 ' HE2' ' A' ' 59' ' ' MET . 11.3 mt -61.5 -43.9 98.04 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.88 0.371 . . . . 0.0 110.06 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.787 ' HB1' ' CZ ' ' B' ' 73' ' ' PHE . . . -55.29 -34.22 63.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.324 0.583 . . . . 0.0 110.942 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.17 -17.01 10.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.195 -179.682 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.502 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.16 13.64 15.77 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.764 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.435 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.5 OUTLIER -157.32 -42.87 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.263 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 20.4 m-70 -75.86 147.67 38.9 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.378 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.35 78.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.477 ' CB ' ' CE2' ' B' ' 73' ' ' PHE . 74.9 m -145.99 -53.55 0.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.623 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.674 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -112.96 -44.97 3.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.743 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 85' ' ' VAL . 7.9 m . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.317 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 4' ' ' THR . . . . . 0.629 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.0 111.16 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.87 -40.29 6.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.081 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.95 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.6 m -70.07 -37.47 75.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.227 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.629 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.67 61.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.028 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -77.44 -26.81 51.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.635 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB3' HD22 ' A' ' 13' ' ' LEU . 81.7 m -72.34 -51.79 19.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.146 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ILE . . . . . 1.076 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -52.89 -56.26 8.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.653 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.3 OUTLIER -52.34 -27.55 15.85 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.935 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.4 OUTLIER -65.89 -55.66 15.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.027 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 13' ' ' LEU . . . . . 1.032 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -71.35 -27.65 63.51 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' ILE . . . . . 1.076 HD11 HG22 ' B' ' 10' ' ' ILE . 7.7 mt -67.31 -37.4 78.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.543 0.687 . . . . 0.0 110.851 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.11 -32.83 61.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.403 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 1.032 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.9 m -52.64 -38.31 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.505 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.5 t80 -77.48 -58.06 3.48 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.092 -1.413 . . . . 0.0 110.486 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 5.8 mm100 -49.07 -35.85 16.94 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -52.32 58.9 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.204 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 20' ' ' TYR . . . . . 0.884 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.8 m-85 -81.22 -47.38 13.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.768 0.794 . . . . 0.0 110.152 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' ALA . . . . . 0.563 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.98 -20.92 26.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.897 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.371 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.327 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 121.033 0.444 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.9 p -133.91 172.77 12.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.294 0.569 . . . . 0.0 110.798 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.884 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -114.41 -144.74 0.39 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.578 -179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.541 ' H ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -160.65 138.01 9.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.615 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -41.6 44.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.809 0.337 . . . . 0.0 111.045 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 33' ' ' THR . . . . . 0.736 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.86 -45.25 62.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.855 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.41 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.6 mt-10 -57.61 -28.96 64.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.213 0.53 . . . . 0.0 109.952 179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' PHE . . . . . 0.456 ' CE2' ' CB ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -67.43 -33.01 74.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.83 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 36' ' ' LEU . . . . . 0.736 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.0 -59.21 4.41 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.437 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' SER . . . . . 0.593 ' O ' HG22 ' B' ' 41' ' ' THR . 68.9 m -54.2 -48.61 70.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.523 -178.375 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.516 ' HA ' HG22 ' B' ' 41' ' ' THR . 31.9 t80 -57.88 -27.42 63.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.858 0.361 . . . . 0.0 110.92 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' MET . . . . . 0.89 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -73.76 -58.19 3.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.209 -179.701 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 1.8 p30 -65.5 -19.32 65.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.051 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.943 HG23 ' HG2' ' B' ' 42' ' ' GLU . 13.3 t -95.98 -31.73 12.93 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' GLU . . . . . 0.943 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -129.25 14.54 6.16 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -177.775 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.776 HD12 ' CE ' ' B' ' 39' ' ' MET . 39.5 mt -161.87 41.47 0.14 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 44' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -75.64 -26.26 57.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.799 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.88 -7.6 36.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.036 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -112.28 -13.96 13.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.89 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.2 p . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' VAL . . . . . 0.777 HG12 HD22 ' B' ' 83' ' ' LEU . 32.0 t . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.887 0.375 . . . . 0.0 111.332 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.629 HD12 ' SD ' ' B' ' 59' ' ' MET . 7.0 tp -75.36 -29.5 59.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.657 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -76.05 -28.25 57.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.666 -178.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.23 -45.19 41.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.744 0.307 . . . . 0.0 111.625 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' MET . . . . . 0.884 ' HE3' HD11 ' B' ' 83' ' ' LEU . 0.9 OUTLIER -54.28 -54.42 40.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.169 0.509 . . . . 0.0 112.112 -179.371 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 60' ' ' MET . . . . . 0.638 ' H ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.548 -179.124 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.42 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 3.6 mm100 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.565 0.221 . . . . 0.0 110.786 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.8 OUTLIER -66.46 -146.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 72' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 1.3 p30 170.72 -169.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.227 0.536 . . . . 0.0 112.147 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.788 ' CB ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -70.15 -63.93 0.99 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.709 -178.785 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 74' ' ' GLN . . . . . 0.404 ' HA ' ' HB2' ' B' ' 77' ' ' LEU . 8.8 tp-100 -66.35 -34.07 77.15 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.561 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.924 ' O ' HD23 ' B' ' 79' ' ' LEU . 1.9 tt0 -45.06 -47.2 11.85 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.861 0.362 . . . . 0.0 110.095 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.9 t80 -71.01 -46.4 62.27 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.356 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 77' ' ' LEU . . . . . 0.707 HD13 ' HA3' ' A' ' 81' ' ' GLY . 7.1 mt -56.83 -40.14 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.39 -39.6 53.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.924 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -60.21 -58.23 9.39 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.559 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.654 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.2 -46.09 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.655 178.865 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.702 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -54.38 -50.13 57.68 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 178.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' GLY . . . . . 0.406 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.43 37.07 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.433 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.884 HD11 ' HE3' ' B' ' 59' ' ' MET . 11.3 mt -61.59 -43.94 97.92 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.878 0.371 . . . . 0.0 110.003 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.8 ' HB1' ' CZ ' ' A' ' 73' ' ' PHE . . . -55.12 -34.24 63.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.402 0.62 . . . . 0.0 110.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -84.32 -16.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.126 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 86' ' ' ALA . . . . . 0.509 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.1 13.59 15.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.775 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 87' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.5 OUTLIER -157.29 -42.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 88' ' ' HIS . . . . . 0.501 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 20.2 m-70 -75.96 147.78 38.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.96 0.41 . . . . 0.0 111.305 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.37 78.69 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 90' ' ' SER . . . . . 0.473 ' CB ' ' CE2' ' A' ' 73' ' ' PHE . 74.9 m -146.01 -53.57 0.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.534 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 91' ' ' PHE . . . . . 0.711 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -112.99 -44.93 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.702 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 92' ' ' VAL . . . . . 0.487 HG13 ' O ' ' B' ' 85' ' ' VAL . 8.1 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.316 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.569 ' HB2' ' HB2' ' B' ' 45' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.773 0.32 . . . . 0.0 111.183 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' A' ' 3' ' ' PRO . 18.0 mtm180 -158.18 -65.07 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.065 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' A' ' 2' ' ' ARG . 78.4 Cg_endo -76.89 4.45 5.7 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.918 2.412 . . . . 0.0 113.885 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.779 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER -68.36 137.91 54.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.477 0.656 . . . . 0.0 111.485 -179.161 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.75 -41.31 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.211 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.918 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -71.08 -39.41 72.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.227 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.779 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.2 mm-40 -51.92 -53.34 42.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.422 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -65.94 -26.64 67.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.184 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.552 ' SG ' HD22 ' B' ' 13' ' ' LEU . 0.3 OUTLIER -64.92 -49.86 68.75 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.353 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.051 HG22 HD11 ' A' ' 14' ' ' ILE . 2.8 mp -61.47 -57.16 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.744 0.307 . . . . 0.0 111.556 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.907 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -52.89 -27.42 18.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.754 -179.286 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.85 -55.44 22.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.702 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.3 mm? -74.22 -28.61 61.33 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -178.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.051 HD11 HG22 ' A' ' 10' ' ' ILE . 6.3 mt -66.88 -37.06 78.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.336 0.589 . . . . 0.0 111.398 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.93 49.06 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.692 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.3 m -52.24 -37.55 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' A' ' 16' ' ' VAL . 3.5 t80 -77.1 -57.95 3.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.277 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.823 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.3 mm-40 -48.98 -47.21 44.37 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.66 -51.8 20.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.69 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.5 m-85 -81.18 -29.76 34.55 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.617 0.722 . . . . 0.0 110.373 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.684 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -84.11 12.96 5.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.281 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 139.55 122.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.749 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -96.69 -28.84 14.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.711 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -123.07 29.04 6.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.799 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.17 107.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.439 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.24 -53.3 1.11 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.954 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.1 m -154.39 -176.45 5.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 90' ' ' SER . 8.9 m -102.4 22.59 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.375 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.684 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.2 p -129.86 -172.17 2.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 31' ' ' SER . 0.2 OUTLIER -142.71 -121.77 0.09 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.868 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.572 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -172.31 130.96 0.6 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.801 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.419 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 20.8 mtmt -50.02 -41.39 47.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 111.088 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -55.97 -28.79 58.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.106 0.479 . . . . 0.0 110.133 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -69.63 -31.98 70.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.104 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.704 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.6 mm? -53.12 -59.07 5.01 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.756 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 p -59.58 -41.8 91.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.645 -1.162 . . . . 0.0 111.866 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.662 ' HA ' HG22 ' A' ' 41' ' ' THR . 78.8 t80 -57.87 -46.97 84.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.87 0.367 . . . . 0.0 111.339 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.751 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -59.93 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.188 -179.549 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -73.3 -19.67 60.99 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.95 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.8 t -98.99 -31.07 11.99 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.95 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.3 mt-10 -132.39 23.82 4.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -177.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.912 HD21 HD11 ' B' ' 10' ' ' ILE . 11.8 mt -163.18 52.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.494 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 48' ' ' LYS . . . -75.27 -27.31 59.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.475 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.553 ' HB2' ' HB2' ' B' ' 1' ' ' SER . . . -60.65 -20.03 59.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 36.7 m-85 -97.61 -30.03 13.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.495 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.3 t -131.41 44.22 2.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.57 108.79 5.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.587 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.3 t30 60.47 20.05 9.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 53.95 35.81 22.84 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -53.09 -28.74 26.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.863 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -133.97 98.71 14.23 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.619 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -83.43 20.33 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.65 2.233 . . . . 0.0 113.012 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.45 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -113.77 -11.25 13.03 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.86 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 86' ' ' ALA . 32.7 t -84.54 -63.11 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.3 -51.54 13.0 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.726 -179.322 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.844 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.0 t70 -55.28 -38.39 68.53 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.397 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -75.0 -32.89 61.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.689 0.28 . . . . 0.0 111.685 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.968 ' CE ' HD21 ' A' ' 83' ' ' LEU . 8.3 tmm? -73.95 -53.06 10.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.825 ' HA ' HD23 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -60.8 -30.4 70.03 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.687 -178.626 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.471 ' HG3' ' N ' ' A' ' 62' ' ' LYS . 1.0 OUTLIER -78.84 -45.21 21.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.471 ' N ' ' HG3' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -80.35 -7.3 59.02 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.464 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.825 HD23 ' HA ' ' A' ' 60' ' ' MET . 4.0 pp -57.16 -18.16 14.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t0 55.29 85.99 0.06 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.853 0.359 . . . . 0.0 110.972 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.695 HD21 HD22 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -88.65 118.37 28.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.328 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -173.85 33.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.2 t -111.5 101.68 10.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.725 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 67.41 10.32 7.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.365 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.87 -26.05 10.51 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.228 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.559 ' O ' HD11 ' A' ' 65' ' ' LEU . 8.7 mm-40 -110.32 -168.47 1.32 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.879 0.339 . . . . 0.0 111.483 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.695 HD22 HD21 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -62.29 -134.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.032 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 3.0 t0 178.58 -171.15 0.12 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 118.569 0.622 . . . . 0.0 111.623 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.814 ' CD2' HG21 ' B' ' 85' ' ' VAL . 41.3 p90 -83.31 -57.75 3.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.27 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 8.6 tp-100 -76.1 -30.71 58.38 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.78 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.763 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -44.7 -42.32 7.51 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.427 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 1.7 t80 -70.01 -54.37 13.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.936 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.441 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.0 mt -53.58 -33.57 55.29 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.429 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.3 m-20 -74.68 -40.84 61.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.296 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.883 HD13 ' SD ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -65.05 -57.81 7.7 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.64 -42.51 48.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.045 179.125 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.86 -50.94 48.23 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.185 -1.007 . . . . 0.0 111.066 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.56 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.37 -41.82 63.51 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.365 -0.922 . . . . 0.0 111.843 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.968 HD21 ' CE ' ' A' ' 59' ' ' MET . 3.2 mt -61.21 -42.29 98.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -54.46 -33.19 59.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.428 0.632 . . . . 0.0 110.338 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.55 -17.77 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.466 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.518 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.59 13.68 20.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.19 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 10.9 t -154.58 -43.32 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.781 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -93.87 -164.73 1.21 Allowed 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.705 0.288 . . . . 0.0 110.917 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.421 ' O ' ' CB ' ' A' ' 90' ' ' SER . 8.5 mt-10 -58.34 -163.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.908 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.555 ' O ' HG12 ' B' ' 28' ' ' VAL . 0.4 OUTLIER 81.62 -57.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.026 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.13 -45.16 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.788 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.482 HG12 ' H ' ' A' ' 93' ' ' LYS . 3.4 t -73.95 166.55 2.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.797 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.482 ' H ' HG12 ' A' ' 92' ' ' VAL . 0.1 OUTLIER 48.51 28.02 1.61 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.285 -179.705 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.8 -37.69 1.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.145 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.752 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -131.76 66.5 78.12 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.075 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.462 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 47.8 Cg_exo -57.37 -46.89 24.8 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.565 2.177 . . . . 0.0 112.326 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 78.7 Cg_endo -87.5 7.99 4.46 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.594 2.196 . . . . 0.0 112.445 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.752 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 2.3 mm-40 -124.67 34.45 5.0 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.059 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -114.9 141.71 47.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.891 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -175.86 4.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.928 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' SER . . . . . 0.553 ' HB2' ' HB2' ' A' ' 45' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.757 0.313 . . . . 0.0 111.219 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' B' ' 3' ' ' PRO . 18.1 mtm180 -158.18 -64.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' B' ' 2' ' ' ARG . 80.2 Cg_endo -77.0 4.44 5.77 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.923 2.416 . . . . 0.0 113.874 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.775 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.2 OUTLIER -68.41 137.88 54.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.434 0.635 . . . . 0.0 111.538 -179.165 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.67 -41.3 6.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.225 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.932 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -71.13 -39.39 72.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.233 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.775 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.95 -53.35 42.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.834 0.35 . . . . 0.0 110.369 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 53.1 mtm180 -65.88 -26.65 67.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.176 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.553 ' SG ' HD22 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -64.98 -49.84 68.7 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.316 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.104 HG22 HD11 ' B' ' 14' ' ' ILE . 2.8 mp -61.58 -57.07 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.702 0.287 . . . . 0.0 111.56 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.913 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -52.85 -27.5 18.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.728 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.81 -55.51 22.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.948 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.3 mm? -74.16 -28.63 61.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.104 HD11 HG22 ' B' ' 10' ' ' ILE . 6.3 mt -66.92 -37.0 78.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 O-C-N 121.722 -0.611 . . . . 0.0 111.428 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.37 -32.98 49.21 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.823 -1.081 . . . . 0.0 112.729 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.948 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.0 m -52.13 -37.62 22.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.464 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.5 t80 -77.03 -58.02 3.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.137 -1.392 . . . . 0.0 110.252 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.811 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.4 mm-40 -49.03 -47.2 44.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.58 -51.9 19.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.668 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.49 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.5 m-85 -81.1 -29.83 34.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.58 0.705 . . . . 0.0 110.45 178.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -84.03 12.97 5.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.628 -1.169 . . . . 0.0 112.346 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 139.55 122.27 1.95 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.734 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -96.65 -28.9 14.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.803 0.335 . . . . 0.0 110.727 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -123.02 28.9 6.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.817 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.34 107.18 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.486 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.14 -53.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.36 . . . . 0.0 110.936 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 22.0 m -154.37 -176.42 5.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 90' ' ' SER . 8.4 m -102.48 22.63 2.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.27 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.2 p -129.84 -172.07 2.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.753 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 31' ' ' SER . 0.2 OUTLIER -142.83 -121.7 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.865 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.58 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -172.38 130.96 0.59 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.422 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 20.8 mtmt -49.96 -41.41 46.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.124 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.706 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.982 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.532 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.98 -28.75 58.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.071 0.462 . . . . 0.0 110.121 179.678 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.513 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -69.66 -32.06 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.055 178.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.6 mm? -53.08 -59.03 5.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.803 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' B' ' 41' ' ' THR . 3.1 p -59.63 -41.74 91.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.919 -178.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.646 ' HA ' HG22 ' B' ' 41' ' ' THR . 78.8 t80 -57.88 -46.98 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 111.311 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.75 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -59.91 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 -179.534 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -73.33 -19.7 60.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.448 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.99 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.9 t -98.98 -31.08 11.99 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.99 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.3 mt-10 -132.32 23.84 4.46 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.917 HD21 HD11 ' A' ' 10' ' ' ILE . 11.8 mt -163.18 52.93 0.17 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.002 0.429 . . . . 0.0 110.399 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' B' ' 48' ' ' LYS . . . -75.21 -27.33 59.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.485 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' ALA . . . . . 0.569 ' HB2' ' HB2' ' A' ' 1' ' ' SER . . . -60.62 -19.92 59.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.598 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 37.0 m-85 -97.74 -30.11 12.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.489 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.3 t -131.35 44.43 2.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 -179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -71.72 108.81 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 4.3 t30 60.56 19.9 9.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.752 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 54.01 35.93 23.27 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -53.16 -28.74 27.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -133.93 98.71 14.29 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.653 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -83.38 20.29 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.681 2.254 . . . . 0.0 112.976 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -113.79 -11.18 13.1 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.625 -0.797 . . . . 0.0 112.889 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.519 HG13 ' HB3' ' B' ' 86' ' ' ALA . 32.7 t -84.53 -63.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.033 0.444 . . . . 0.0 111.47 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.847 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.32 -51.5 13.06 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.727 -179.259 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.847 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.0 t70 -55.36 -38.47 68.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.32 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -74.92 -32.89 61.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.731 0.3 . . . . 0.0 111.666 -179.456 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.967 ' CE ' HD21 ' B' ' 83' ' ' LEU . 8.3 tmm? -74.05 -52.95 11.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.826 ' HA ' HD23 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -60.81 -30.35 70.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.739 -178.668 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' B' ' 62' ' ' LYS . 1.0 OUTLIER -78.9 -45.24 21.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.476 ' N ' ' HG3' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -80.23 -7.39 58.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.507 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.843 HD22 HD11 ' B' ' 79' ' ' LEU . 4.0 pp -57.15 -18.22 14.26 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 t0 55.38 85.94 0.06 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.707 HD21 HD22 ' B' ' 71' ' ' LEU . 0.2 OUTLIER -88.68 118.31 28.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.076 0.465 . . . . 0.0 111.39 -179.334 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -173.75 33.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.634 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 7.2 t -111.52 101.73 10.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.687 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 67.35 10.28 7.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.39 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.9 -26.0 10.64 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.186 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.554 ' O ' HD11 ' B' ' 65' ' ' LEU . 8.7 mm-40 -110.37 -168.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.909 0.355 . . . . 0.0 111.464 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.707 HD22 HD21 ' B' ' 65' ' ' LEU . 0.4 OUTLIER -62.36 -134.97 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.95 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 3.1 t0 178.64 -171.12 0.12 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.494 0.588 . . . . 0.0 111.532 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 41.6 p90 -83.2 -57.8 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.274 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.479 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 8.6 tp-100 -76.1 -30.68 58.35 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.761 -179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.758 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -44.75 -42.34 7.63 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.513 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.7 t80 -70.0 -54.28 13.9 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.983 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.0 mt -53.58 -33.6 55.39 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.3 m-20 -74.76 -40.7 61.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.312 178.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.882 HD13 ' SD ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -65.06 -57.84 7.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.434 -179.388 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.73 -42.39 47.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.082 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.43 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.98 -50.89 49.18 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.06 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.34 -41.86 63.27 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.787 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.967 HD21 ' CE ' ' B' ' 59' ' ' MET . 3.2 mt -61.2 -42.23 98.23 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.921 0.391 . . . . 0.0 110.135 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.518 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -54.57 -33.13 59.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.414 0.626 . . . . 0.0 110.327 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.814 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.373 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.519 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -112.71 13.78 19.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.112 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.426 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 10.9 t -154.65 -43.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.841 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -94.09 -164.78 1.21 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.784 0.326 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' B' ' 90' ' ' SER . 8.7 mt-10 -58.34 -163.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.887 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.55 ' O ' HG12 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 81.61 -57.42 0.25 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.012 -179.799 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.11 -45.19 2.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.888 0.375 . . . . 0.0 110.829 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.498 HG12 ' H ' ' B' ' 93' ' ' LYS . 3.4 t -73.87 166.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.498 ' H ' HG12 ' B' ' 92' ' ' VAL . 0.1 OUTLIER 48.53 27.94 1.59 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.291 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.78 -37.65 1.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.205 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.769 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -131.76 66.47 78.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.469 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 47.9 Cg_exo -57.35 -46.96 24.41 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.579 2.186 . . . . 0.0 112.369 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 75.8 Cg_endo -87.38 8.02 4.48 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.635 2.224 . . . . 0.0 112.562 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.769 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 2.3 mm-40 -124.71 34.29 5.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.087 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -114.78 141.81 47.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.882 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 -175.87 4.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.205 -0.903 . . . . 0.0 110.924 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.444 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -95.72 -53.05 0.23 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.124 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.444 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 31.4 Cg_exo -63.53 -127.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.895 2.397 . . . . 0.0 111.842 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -144.48 145.23 31.76 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.307 0.575 . . . . 0.0 111.076 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.87 -44.58 9.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.322 -0.853 . . . . 0.0 111.056 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.981 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.2 -40.45 94.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.914 178.888 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -50.98 -36.05 37.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.575 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.73 -26.89 40.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.582 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.626 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.7 p -68.07 -41.95 81.15 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.639 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 3.4 mp -72.09 -54.51 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.53 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.956 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.66 -27.35 11.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.649 ' O ' HG13 ' A' ' 16' ' ' VAL . 52.2 m -77.59 -56.03 4.87 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.771 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.733 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -57.95 -27.85 63.78 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.968 0.413 . . . . 0.0 111.778 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 13.4 mt -71.81 -39.57 68.2 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-O 121.573 0.701 . . . . 0.0 110.512 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.455 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -77.47 -38.26 49.62 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.935 -1.484 . . . . 0.0 112.084 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.6 m -52.6 -33.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.47 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 1.6 t80 -80.51 -58.48 3.1 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.943 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.931 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.47 -27.53 64.3 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.899 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -50.28 72.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.202 0.525 . . . . 0.0 109.685 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.529 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 3.1 m-85 -79.44 -28.47 41.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.479 178.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.931 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -80.36 2.19 25.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.016 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.08 141.85 11.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.633 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.57 -32.13 6.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 110.835 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.84 124.89 45.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.1 -30.17 10.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.525 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.5 m80 61.36 112.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 0.0 110.877 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.508 ' C ' HG23 ' A' ' 28' ' ' VAL . 8.5 m -109.72 -28.46 8.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.078 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.508 HG23 ' C ' ' A' ' 27' ' ' SER . 4.8 t 81.64 -6.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.824 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.711 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p -139.29 -179.8 6.08 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.813 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.3 0.19 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.435 -179.698 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 28.8 t -173.63 126.71 0.4 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.121 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -49.82 -36.34 26.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.422 -179.126 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.09 -43.08 58.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.072 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.24 59.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 110.154 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.935 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -72.92 -29.45 63.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.908 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -59.13 -59.24 5.78 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.545 0.688 . . . . 0.0 111.507 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.425 ' O ' HG22 ' A' ' 41' ' ' THR . 33.7 t -68.03 -50.41 55.53 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.464 -178.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.529 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.8 m-85 -57.93 -25.89 61.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.228 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.607 ' HE2' HD13 ' A' ' 43' ' ' LEU . 1.5 ttm -78.17 -53.66 7.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.056 0.455 . . . . 0.0 110.531 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.69 30.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.095 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.937 HG23 ' HG2' ' A' ' 42' ' ' GLU . 9.2 t -96.87 -30.28 13.23 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.937 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -125.94 -42.18 1.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.558 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.664 HD21 HD11 ' B' ' 10' ' ' ILE . 7.4 mt -101.88 34.94 2.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.315 0.579 . . . . 0.0 110.162 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.479 ' HB1' ' HB3' ' A' ' 48' ' ' LYS . . . -81.16 -28.84 34.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.924 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.55 -25.54 17.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' ' CE1' ' A' ' 88' ' ' HIS . 4.5 m-85 -102.32 17.05 24.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.088 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t -178.45 45.67 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.901 0.382 . . . . 0.0 110.992 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HB3' ' HB1' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -120.04 -37.52 3.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.79 28.8 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.824 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -78.92 -22.34 45.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 tttm 65.3 30.95 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.708 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -131.85 83.18 57.93 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -61.55 -16.31 47.09 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.633 2.222 . . . . 0.0 112.348 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -71.94 -14.27 75.9 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.793 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 86' ' ' ALA . 61.7 t -84.2 -59.48 2.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.56 -50.94 63.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.663 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -57.01 -26.69 60.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.064 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.53 -50.05 75.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.827 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE2' HD21 ' A' ' 83' ' ' LEU . 1.3 ptp -56.36 -53.5 56.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.062 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.934 ' O ' HD22 ' A' ' 63' ' ' LEU . 3.6 mmt -64.33 -22.75 67.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.891 -179.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.5 mmmt -78.46 -61.66 1.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.919 0.39 . . . . 0.0 110.685 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 6.09 15.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.068 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.934 HD22 ' O ' ' A' ' 60' ' ' MET . 1.3 pt? -50.41 -24.76 3.27 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.523 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER 69.15 64.18 0.29 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.973 0.416 . . . . 0.0 110.735 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.703 HD23 ' HG ' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -121.85 156.54 33.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -156.23 -74.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.889 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.7 p -167.04 130.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 99.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.805 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' O ' HG21 ' A' ' 29' ' ' THR . . . 159.94 -29.45 0.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.471 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 60.16 -167.78 0.17 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.626 0.25 . . . . 0.0 110.846 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -63.27 -135.41 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER 172.79 -168.7 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.761 0.71 . . . . 0.0 111.753 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.7 ' CG ' HG11 ' B' ' 85' ' ' VAL . 31.8 p90 -76.21 -60.71 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.612 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.496 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.32 -25.61 39.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.438 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.7 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.4 OUTLIER -46.4 -31.77 2.84 Favored 'General case' 0 CA--C 1.522 -0.124 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.683 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.644 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.5 t80 -80.33 -54.35 5.8 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.856 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 77' ' ' LEU . 7.3 mt -55.95 -33.52 64.81 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.726 179.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.85 -37.46 58.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.935 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.1 mp -66.08 -58.19 6.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.023 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.872 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.08 -44.77 49.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.562 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.474 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.82 -49.31 54.79 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.58 -43.59 53.2 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.363 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.4 mt -56.85 -44.84 82.53 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 110.018 178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.484 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.47 -41.62 73.21 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.186 0.517 . . . . 0.0 110.913 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.695 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -73.74 -17.11 17.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.285 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -109.11 16.37 22.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.565 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 44.8 t -158.38 -35.88 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -118.35 -67.87 0.96 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.688 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.693 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 2.1 mm-40 -36.55 156.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.128 0.49 . . . . 0.0 112.234 -178.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.19 66.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.146 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.41 -48.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.718 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.87 -24.99 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.135 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -78.64 -20.9 49.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.56 27.98 3.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.821 0.343 . . . . 0.0 111.333 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.717 ' HB3' ' HD3' ' A' ' 96' ' ' PRO . . . -88.02 -51.48 0.4 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.126 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.717 ' HD3' ' HB3' ' A' ' 95' ' ' ALA . 54.4 Cg_exo -54.14 -46.81 30.76 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.718 2.279 . . . . 0.0 112.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 62.6 Cg_endo -73.6 -33.97 6.13 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.091 1.86 . . . . 0.0 112.377 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.14 135.91 38.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.823 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -113.42 125.54 54.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.952 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.6 -45.02 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.915 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.735 0.303 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.438 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 0.0 OUTLIER -95.78 -52.99 0.23 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.098 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 31.5 Cg_exo -63.5 -127.25 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 122.926 2.417 . . . . 0.0 111.873 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -144.55 145.29 31.75 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.363 0.601 . . . . 0.0 110.966 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.83 -44.66 9.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.998 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.21 -40.43 94.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.824 178.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.05 -36.14 38.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.47 -179.826 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.71 -26.82 40.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.636 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.631 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -67.93 -42.15 81.48 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.017 HG22 HD11 ' B' ' 14' ' ' ILE . 3.4 mp -71.93 -54.52 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.629 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.76 -27.23 11.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 52.2 m -77.69 -56.0 4.88 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.819 -0.352 . . . . 0.0 111.755 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.73 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.7 mm? -57.9 -27.8 63.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.991 0.424 . . . . 0.0 111.796 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.017 HD11 HG22 ' B' ' 10' ' ' ILE . 13.7 mt -71.96 -39.58 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 CA-C-O 121.481 0.658 . . . . 0.0 110.417 178.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ALA . . . . . 0.465 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -77.42 -38.31 49.91 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.967 -1.47 . . . . 0.0 112.105 -176.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.73 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.3 m -52.56 -33.61 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.472 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 1.6 t80 -80.4 -58.66 3.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.436 -1.256 . . . . 0.0 112.897 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.926 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.38 -27.54 64.4 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -50.3 72.12 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.522 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 3.1 m-85 -79.35 -28.55 42.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.515 178.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.926 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -80.4 2.41 25.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.103 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 92.91 141.89 11.06 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.71 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.51 -32.19 6.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.811 0.338 . . . . 0.0 110.895 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.82 125.02 45.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.09 -30.2 10.88 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.508 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 6.5 m80 61.27 112.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.859 0.361 . . . . 0.0 110.937 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' SER . . . . . 0.513 ' C ' HG23 ' B' ' 28' ' ' VAL . 8.3 m -109.65 -28.5 8.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.051 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.513 HG23 ' C ' ' B' ' 27' ' ' SER . 4.8 t 81.58 -6.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.802 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.706 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p -139.33 -179.91 6.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.967 0.413 . . . . 0.0 110.773 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.685 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.21 0.19 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.504 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 28.7 t -173.7 126.56 0.39 Allowed 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.812 0.339 . . . . 0.0 110.092 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.435 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.4 OUTLIER -49.68 -36.43 25.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.459 -179.174 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.652 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.07 -43.06 59.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.061 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.504 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.25 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.98 0.419 . . . . 0.0 110.094 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.946 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -72.91 -29.43 63.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.941 179.073 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.652 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -59.19 -59.16 5.91 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.562 0.696 . . . . 0.0 111.565 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.429 ' O ' HG22 ' B' ' 41' ' ' THR . 33.6 t -67.95 -50.42 55.98 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.528 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.522 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.9 m-85 -57.99 -25.96 61.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.129 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.594 ' HE1' HD13 ' B' ' 43' ' ' LEU . 1.5 ttm -78.16 -53.61 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.047 0.451 . . . . 0.0 110.541 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.65 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.149 -179.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.958 HG23 ' HG2' ' B' ' 42' ' ' GLU . 9.2 t -96.83 -30.32 13.23 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.958 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.4 OUTLIER -125.9 -42.15 1.92 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.572 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.678 HD21 HD11 ' A' ' 10' ' ' ILE . 7.4 mt -101.89 34.99 2.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.291 0.567 . . . . 0.0 110.053 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' B' ' 48' ' ' LYS . . . -81.27 -28.77 34.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.903 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.62 -25.51 17.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.801 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.421 ' CZ ' ' CE1' ' B' ' 88' ' ' HIS . 4.5 m-85 -102.29 16.96 24.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.08 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t -178.3 45.62 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.864 0.364 . . . . 0.0 111.003 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.485 ' HB3' ' HB1' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -120.03 -37.56 3.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.028 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.71 28.71 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -78.88 -22.42 45.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 tttm 65.33 30.9 10.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.783 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -131.8 83.15 58.21 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.879 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.32 -16.51 47.35 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.742 2.295 . . . . 0.0 112.379 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -71.91 -14.22 75.82 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.845 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' B' ' 86' ' ' ALA . 62.0 t -84.21 -59.49 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 111.215 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.51 -51.06 62.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -56.93 -26.76 60.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.063 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -58.52 -50.0 75.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.818 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 1.3 ptp -56.34 -53.53 56.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.086 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.937 ' O ' HD22 ' B' ' 63' ' ' LEU . 3.6 mmt -64.22 -22.86 67.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.879 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 7.5 mmmt -78.44 -61.77 1.9 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 6.01 15.09 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.092 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.937 HD22 ' O ' ' B' ' 60' ' ' MET . 1.3 pt? -50.32 -24.77 3.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.519 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.8 OUTLIER 69.12 64.21 0.29 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.693 HD23 ' HG ' ' B' ' 63' ' ' LEU . 0.5 OUTLIER -121.84 156.61 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.719 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -156.27 -74.26 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.932 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 7.5 p -167.02 130.72 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.833 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 99.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.453 ' O ' HG21 ' B' ' 29' ' ' THR . . . 159.89 -29.42 0.37 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.458 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 60.25 -167.71 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.517 0.199 . . . . 0.0 110.864 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -63.39 -135.42 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.484 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 0.8 OUTLIER 172.91 -168.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.819 0.736 . . . . 0.0 111.756 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.695 ' CG ' HG11 ' A' ' 85' ' ' VAL . 31.8 p90 -76.31 -60.62 2.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.568 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.507 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.38 -25.53 39.08 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.441 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.711 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.4 OUTLIER -46.46 -31.75 2.88 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.659 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.5 t80 -80.29 -54.45 5.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.805 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -55.93 -33.54 64.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.68 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -75.82 -37.43 59.09 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.946 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.1 mp -66.06 -58.2 6.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.111 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.86 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.1 -44.77 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.54 179.047 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.481 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.8 -49.3 54.7 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 178.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.479 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.44 -43.62 52.34 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.44 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.4 mt -56.86 -44.85 82.58 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 110.025 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' GLU . . . -55.45 -41.66 73.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.205 0.526 . . . . 0.0 110.897 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.7 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -73.69 -17.27 17.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.209 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -108.95 16.37 22.7 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.54 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 44.6 t -158.38 -35.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -118.29 -67.79 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.696 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 2.1 mm-40 -36.52 156.47 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.14 66.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.159 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.49 -49.01 0.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.723 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -68.81 -25.0 29.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -78.69 -20.83 49.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.171 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.57 27.92 3.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.795 0.331 . . . . 0.0 111.319 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.709 ' HB3' ' HD3' ' B' ' 96' ' ' PRO . . . -88.05 -51.32 0.4 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.709 ' HD3' ' HB3' ' B' ' 95' ' ' ALA . 55.3 Cg_exo -54.27 -46.7 31.57 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.736 2.29 . . . . 0.0 112.852 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 62.4 Cg_endo -73.65 -34.09 5.93 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.167 1.911 . . . . 0.0 112.367 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.12 135.83 38.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.793 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -113.31 125.55 54.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.61 -45.0 1.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.917 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.889 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.863 0.363 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 61.1 103.79 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.831 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -61.14 -124.68 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.909 2.406 . . . . 0.0 111.869 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.687 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -170.96 144.05 2.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.34 0.59 . . . . 0.0 111.254 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.91 -41.78 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.97 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.924 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -67.94 -38.75 83.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.048 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.687 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.4 -33.46 30.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.437 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -27.11 41.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.562 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.572 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.4 p -69.07 -45.16 71.03 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.087 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -65.98 -56.37 15.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.49 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.95 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.17 -27.27 13.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.674 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.542 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -69.84 -55.52 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.923 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.087 HD11 HG22 ' A' ' 10' ' ' ILE . 8.3 mt -69.47 -35.45 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-O 121.216 0.531 . . . . 0.0 110.778 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.37 51.21 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.538 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.923 HG22 ' O ' ' A' ' 13' ' ' LEU . 29.6 m -63.53 -37.11 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.167 0.508 . . . . 0.0 109.943 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.458 ' CE1' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.53 -60.1 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.847 -178.602 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.967 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -58.18 -26.66 63.04 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.443 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.36 -52.16 48.12 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.306 -0.557 . . . . 0.0 109.708 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.646 ' HB3' HD11 ' A' ' 30' ' ' LEU . 2.9 m-85 -80.53 -29.77 37.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.62 0.724 . . . . 0.0 109.235 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.967 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -83.3 20.08 1.38 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.523 -1.217 . . . . 0.0 112.218 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.18 124.4 2.14 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.501 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -114.93 30.55 7.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.779 0.323 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -136.21 -50.42 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.954 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.66 71.47 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.526 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -148.59 97.26 2.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.83 0.347 . . . . 0.0 110.826 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.5 m 62.24 147.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.945 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m -104.27 37.62 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 5.9 p -146.11 158.76 43.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.09 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -117.39 -156.16 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.893 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.512 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -137.88 136.45 37.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 179.085 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' HD23 ' A' ' 36' ' ' LEU . 21.5 mtmt -49.86 -39.78 40.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.688 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.31 -44.58 51.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.28 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.436 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 1.3 tt0 -59.81 -29.14 68.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 0.0 109.941 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -75.59 -26.61 58.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.552 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.649 ' HB2' ' O ' ' A' ' 33' ' ' THR . 2.4 mm? -51.35 -59.26 4.42 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.686 0.755 . . . . 0.0 110.647 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.15 69.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.477 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 12.5 t80 -57.84 -28.98 64.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.402 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.459 ' CE ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -78.0 -35.94 49.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.055 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.769 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 59.7 m-80 -73.21 -19.78 61.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.212 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.78 -78.57 0.59 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.139 0.495 . . . . 0.0 111.606 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 1.9 mm-40 -51.36 -28.41 12.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.032 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.706 HD21 HD11 ' B' ' 10' ' ' ILE . 39.3 mt -134.57 51.48 2.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 110.478 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.769 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.75 -25.39 53.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.946 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.86 -14.52 63.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.134 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.42 -21.54 15.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.26 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -108.0 -21.14 12.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.377 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.68 ' HE2' ' HB1' ' A' ' 44' ' ' ALA . 18.1 mttm -55.13 135.4 49.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.131 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.405 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.7 OUTLIER 80.41 -43.14 0.23 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.52 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.8 30.71 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.882 0.373 . . . . 0.0 110.78 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -27.58 63.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.37 75.4 0.37 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.802 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.5 87.99 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.556 2.171 . . . . 0.0 112.234 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.55 -39.14 0.16 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.41 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 86' ' ' ALA . 22.9 t -51.78 -63.03 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.898 0.38 . . . . 0.0 111.386 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -51.1 70.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.756 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.82 -30.89 62.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.372 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -42.75 92.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.008 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.855 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -63.43 -53.54 50.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.339 -179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.91 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -60.56 -29.75 69.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.298 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -59.55 2.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.893 0.378 . . . . 0.0 110.792 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 6.13 13.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.875 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.91 HD22 ' O ' ' A' ' 60' ' ' MET . 1.8 pt? -44.85 -33.26 1.87 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.985 0.422 . . . . 0.0 111.516 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.588 ' H ' HD23 ' A' ' 63' ' ' LEU . 36.5 t70 43.91 82.7 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.9 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.744 HD21 HD12 ' A' ' 63' ' ' LEU . 38.2 mt -88.48 107.24 18.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.89 0.376 . . . . 0.0 110.663 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -94.59 -33.96 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.015 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.01 -175.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.855 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.36 -23.93 26.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.092 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 155.83 -24.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 3.8 mm100 -69.73 173.33 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.062 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.606 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -65.9 -136.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.501 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.03 -164.9 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.602 0.637 . . . . 0.0 111.603 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.916 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.3 p90 -81.71 -57.2 3.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.357 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.517 HE22 ' HB3' ' A' ' 77' ' ' LEU . 7.6 tp-100 -80.35 -27.91 38.2 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.325 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -44.78 -36.59 3.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.649 ' CD2' HG23 ' A' ' 16' ' ' VAL . 2.0 t80 -80.38 -54.24 5.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.036 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.635 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.5 mt -50.12 -34.55 22.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.84 -38.46 53.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 75' ' ' GLU . 1.8 mp -63.82 -58.15 7.7 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.798 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.893 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.6 -42.37 63.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.174 178.772 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.92 51.81 Favored Glycine 0 CA--C 1.507 -0.446 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.598 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.54 -40.26 46.91 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.426 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.855 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.3 mt -60.26 -45.53 92.95 Favored 'General case' 0 C--O 1.23 0.056 0 O-C-N 122.571 -0.37 . . . . 0.0 110.327 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.44 -30.76 61.11 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.175 0.512 . . . . 0.0 110.843 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.91 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.99 -17.48 9.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.168 -179.657 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.718 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.31 12.83 17.7 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.199 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.14 -37.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.506 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.1 OUTLIER -89.37 -171.08 3.09 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.913 0.387 . . . . 0.0 111.3 -179.686 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.61 55.18 3.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.4 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.798 ' OG ' HG23 ' B' ' 14' ' ' ILE . 0.6 OUTLIER -117.57 -47.68 2.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.953 0.406 . . . . 0.0 110.412 179.377 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.755 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -135.37 -81.55 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.423 179.289 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 91' ' ' PHE . 7.2 m 45.15 18.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 179.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 92' ' ' VAL . 0.0 OUTLIER 61.57 23.03 13.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.998 0.428 . . . . 0.0 110.942 -179.536 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 52.94 68.44 0.84 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.012 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.639 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -139.03 57.03 10.01 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.545 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.511 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 32.2 Cg_exo -59.84 -48.16 13.49 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.44 2.094 . . . . 0.0 112.638 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.466 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 62.8 Cg_endo -90.52 29.46 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.77 2.313 . . . . 0.0 112.769 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.639 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.2 OUTLIER -96.33 -26.98 15.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.196 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -58.52 -51.79 68.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.012 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.23 29.79 0.89 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.869 0.366 . . . . 0.0 111.413 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.872 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.824 0.345 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 61.11 103.67 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -60.99 -124.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.909 2.406 . . . . 0.0 111.893 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.672 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -170.97 144.1 2.1 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.342 0.592 . . . . 0.0 111.25 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -41.76 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.953 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.903 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -68.0 -38.71 82.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.029 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.672 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.31 -33.56 29.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.469 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.59 -27.17 41.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.519 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.4 p -69.08 -45.1 71.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.211 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -66.09 -56.31 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.404 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.24 -27.21 13.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.679 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.3 OUTLIER -69.9 -55.56 9.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.32 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.907 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -68.51 -27.25 65.95 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.3 mt -69.42 -35.47 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-O 121.217 0.532 . . . . 0.0 110.832 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.38 51.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.408 -1.269 . . . . 0.0 112.613 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.907 HG22 ' O ' ' B' ' 13' ' ' LEU . 29.3 m -63.46 -37.2 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 109.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -80.48 -60.02 2.48 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.881 -178.605 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.915 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.1 OUTLIER -58.19 -26.75 63.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.28 -52.08 48.29 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.737 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.641 ' HB3' HD11 ' B' ' 30' ' ' LEU . 2.8 m-85 -80.64 -29.8 36.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.656 0.741 . . . . 0.0 109.215 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.915 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -83.3 20.13 1.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.172 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.14 124.32 2.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.533 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -114.83 30.49 7.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 110.81 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -136.24 -50.41 0.69 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.926 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.72 71.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.591 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -148.6 97.17 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.734 0.302 . . . . 0.0 110.885 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m 62.39 147.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m -104.2 37.62 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.969 0.414 . . . . 0.0 111.138 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 5.8 p -146.19 158.75 43.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.034 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.762 HD12 ' CD2' ' B' ' 35' ' ' PHE . 0.0 OUTLIER -117.43 -156.14 0.62 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.88 179.598 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.511 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -137.89 136.41 37.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.947 0.403 . . . . 0.0 110.545 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.501 ' O ' HD23 ' B' ' 36' ' ' LEU . 21.5 mtmt -49.87 -39.75 40.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.673 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.646 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.29 -44.67 51.75 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.27 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.441 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 1.3 tt0 -59.88 -28.98 68.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.223 0.535 . . . . 0.0 109.987 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.762 ' CD2' HD12 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -75.6 -26.61 57.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.58 179.415 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' B' ' 33' ' ' THR . 2.4 mm? -51.49 -59.21 4.51 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.709 0.766 . . . . 0.0 110.571 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.17 69.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.422 -1.263 . . . . 0.0 110.407 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.466 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 12.6 t80 -57.92 -28.86 64.65 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.389 179.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.464 ' CE ' HD12 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -78.14 -35.84 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.942 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.768 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 59.8 m-80 -73.26 -19.79 60.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.178 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.81 -78.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 111.602 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.466 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 1.9 mm-40 -51.34 -28.39 12.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.082 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' A' ' 10' ' ' ILE . 38.7 mt -134.64 51.56 2.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.033 0.444 . . . . 0.0 110.482 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.768 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.83 -25.35 53.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.932 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.78 -14.52 63.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.174 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.45 -21.5 15.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.2 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -108.03 -21.18 12.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.412 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.695 ' HE2' ' HB1' ' B' ' 44' ' ' ALA . 18.0 mttm -55.09 135.4 49.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.174 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ASN . . . . . 0.402 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER 80.45 -43.28 0.23 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.465 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.91 30.68 3.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.844 0.354 . . . . 0.0 110.758 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -27.66 64.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.866 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.33 75.3 0.36 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.779 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -68.47 87.96 0.41 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.524 2.149 . . . . 0.0 112.324 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.55 -39.16 0.16 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.418 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.717 HG22 ' O ' ' B' ' 86' ' ' ALA . 22.6 t -51.77 -63.08 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.893 0.377 . . . . 0.0 111.391 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -50.97 70.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.85 -30.91 62.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.347 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -42.79 92.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.866 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.4 OUTLIER -63.48 -53.51 51.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.32 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.897 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -60.59 -29.73 69.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.299 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 -59.52 2.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 0.0 110.83 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.46 6.17 13.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.832 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.897 HD22 ' O ' ' B' ' 60' ' ' MET . 1.8 pt? -44.83 -33.24 1.85 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 111.574 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.572 ' H ' HD23 ' B' ' 63' ' ' LEU . 36.5 t70 43.87 82.67 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.913 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.733 HD21 HD12 ' B' ' 63' ' ' LEU . 38.3 mt -88.44 107.27 18.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.926 0.393 . . . . 0.0 110.706 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -94.59 -33.99 12.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.02 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -175.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -23.93 28.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.09 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 155.92 -24.56 0.55 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.565 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.509 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 3.9 mm100 -69.66 173.3 6.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.609 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.4 OUTLIER -65.83 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 172.01 -164.89 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.574 0.625 . . . . 0.0 111.613 179.512 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.91 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.4 p90 -81.73 -57.16 3.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.384 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.514 HE22 ' HB3' ' B' ' 77' ' ' LEU . 7.6 tp-100 -80.38 -27.8 38.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.348 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.811 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -44.94 -36.52 3.41 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CD2' HG23 ' B' ' 16' ' ' VAL . 2.0 t80 -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.077 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.5 mt -50.17 -34.53 22.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.86 -38.58 53.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.811 HD13 ' O ' ' B' ' 75' ' ' GLU . 1.8 mp -63.77 -58.24 7.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.713 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.905 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.66 -42.33 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.15 178.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.68 -50.04 50.83 Favored Glycine 0 CA--C 1.507 -0.461 0 N-CA-C 109.989 -1.245 . . . . 0.0 109.989 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.594 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.38 -40.39 45.95 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.403 -0.903 . . . . 0.0 111.446 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.866 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.1 mt -60.17 -45.63 92.45 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.332 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.585 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.36 -30.8 61.01 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.281 0.562 . . . . 0.0 110.891 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.916 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.04 -17.34 9.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.227 -179.639 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.717 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.35 12.79 17.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.194 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.16 -37.24 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.459 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.1 OUTLIER -89.3 -171.07 3.1 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.838 0.351 . . . . 0.0 111.356 -179.727 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.57 55.16 3.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.447 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.805 ' OG ' HG23 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -117.6 -47.59 2.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.406 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -135.43 -81.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.412 179.296 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.571 HG22 ' O ' ' B' ' 91' ' ' PHE . 7.2 m 45.07 18.57 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' B' ' 92' ' ' VAL . 0.0 OUTLIER 61.68 23.04 13.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.893 0.378 . . . . 0.0 110.815 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . 53.01 68.35 0.85 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.999 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.652 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -138.99 57.08 10.18 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.559 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.5 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 32.1 Cg_exo -59.82 -48.15 13.58 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.668 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.488 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 62.6 Cg_endo -90.55 29.39 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.766 2.311 . . . . 0.0 112.78 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.652 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.2 OUTLIER -96.16 -27.05 15.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.19 -179.795 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -58.46 -51.83 68.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.034 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.32 29.71 0.9 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.372 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.848 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.774 0.321 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.413 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 0.3 OUTLIER 179.79 -51.33 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.039 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 23.9 Cg_exo -68.49 -132.65 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 123.006 2.471 . . . . 0.0 111.953 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.576 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 175.32 150.78 0.11 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.389 0.614 . . . . 0.0 110.985 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.8 -49.23 10.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.442 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.812 HG23 ' CG1' ' B' ' 16' ' ' VAL . 3.9 m -64.12 -32.44 74.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.482 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.576 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.65 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.34 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' O ' ' OG ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -74.79 -26.86 60.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.372 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.566 ' HB3' HD22 ' B' ' 13' ' ' LEU . 73.7 m -68.14 -53.9 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.511 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.129 HG22 HD11 ' A' ' 14' ' ' ILE . 1.8 mp -50.77 -56.36 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.837 0.351 . . . . 0.0 111.355 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.822 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -53.88 -27.78 32.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.886 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -61.8 -55.61 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.268 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.047 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.75 55.93 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.129 HD11 HG22 ' A' ' 10' ' ' ILE . 5.3 mt -49.79 -29.29 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.103 0.478 . . . . 0.0 112.18 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.3 -31.75 21.43 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.842 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.047 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.6 m -53.32 -33.71 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.759 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.8 -56.44 4.13 Favored 'General case' 0 N--CA 1.46 0.06 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.79 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 8.6 mm-40 -48.54 -26.05 2.0 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.461 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.71 69.12 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.627 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -80.37 -50.4 10.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.947 0.879 . . . . 0.0 109.805 178.533 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.616 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -61.58 -52.14 65.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.929 -1.487 . . . . 0.0 112.167 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.17 -92.96 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 68.15 -68.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.734 0.302 . . . . 0.0 111.008 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -147.09 133.14 19.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.23 -28.54 12.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.471 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.98 83.53 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.786 0.327 . . . . 0.0 110.895 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.14 167.81 9.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.76 HG12 ' O ' ' B' ' 90' ' ' SER . 29.6 m -98.21 26.52 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.25 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.616 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 p -149.22 -177.58 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.975 0.417 . . . . 0.0 111.15 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.627 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -141.55 -124.95 0.1 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.117 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.599 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -171.44 128.48 0.68 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.571 ' HG2' ' HE1' ' A' ' 60' ' ' MET . 19.6 mtmm -49.64 -41.17 41.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.858 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.643 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.65 -41.68 59.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.164 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.6 mt-10 -55.74 -28.84 57.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -26.91 59.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.236 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -61.19 -59.15 5.77 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.488 0.661 . . . . 0.0 111.672 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.8 p -64.6 -51.16 64.15 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.611 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.556 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.7 m-85 -58.05 -50.88 71.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.979 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.798 ' HG2' HG21 ' A' ' 47' ' ' THR . 3.3 ttm -58.62 -26.98 64.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.747 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 13.3 m-20 -73.25 -19.46 61.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.73 -79.96 0.59 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.511 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.66 -46.22 63.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.234 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.721 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -111.21 38.46 2.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.0 110.318 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.747 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.1 -30.32 58.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.774 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.28 -25.15 13.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.987 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.5 m-85 -109.39 23.65 14.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.011 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.798 HG21 ' HG2' ' A' ' 39' ' ' MET . 4.2 t -179.73 39.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.87 0.367 . . . . 0.0 110.972 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HB3' ' HB1' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -118.19 -35.84 3.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.07 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -163.04 30.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -71.33 158.47 36.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -28.29 65.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.999 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.612 ' HB3' HG23 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -112.79 106.39 55.37 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.42 8.16 4.56 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.523 2.149 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.01 -3.01 36.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.852 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.612 HG23 ' HB3' ' A' ' 52' ' ' ASP . 95.7 t -55.35 -53.29 37.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 120.694 0.283 . . . . 0.0 111.229 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.856 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -67.37 -52.29 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.163 0.506 . . . . 0.0 110.663 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.856 ' N ' HD23 ' A' ' 56' ' ' LEU . 3.8 t0 -59.07 -26.8 64.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.678 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.432 ' HA ' ' HG3' ' A' ' 61' ' ' LYS . 8.4 mmt85 -64.85 -43.26 93.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.917 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -60.87 -53.29 59.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.892 0.377 . . . . 0.0 111.522 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.86 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -73.42 -31.68 63.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.031 -177.916 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.493 ' HG3' ' H ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -78.14 -51.57 10.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.833 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.493 ' H ' ' HG3' ' A' ' 61' ' ' LYS . 8.5 tmtm? -81.74 4.17 22.95 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.86 HD22 ' O ' ' A' ' 60' ' ' MET . 1.1 pt? -44.36 -30.08 0.78 Allowed 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.742 ' H ' HD23 ' A' ' 63' ' ' LEU . 30.9 t70 32.35 37.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.264 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -159.88 24.21 0.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.152 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.768 ' HB3' HD11 ' A' ' 63' ' ' LEU . 53.4 p30 -60.93 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.854 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 m -176.94 134.33 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.776 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -55.89 -23.4 31.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.935 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.65 -90.9 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.573 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.473 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 7.6 mm100 -149.39 -170.1 3.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.575 0.226 . . . . 0.0 111.021 -179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.702 HD12 ' HD1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -61.32 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 9.4 t70 166.72 159.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.941 0.791 . . . . 0.0 111.226 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.786 ' CG ' HG11 ' B' ' 85' ' ' VAL . 27.8 p90 -50.22 -58.65 5.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.519 -0.764 . . . . 0.0 113.004 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.5 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 7.2 tp-100 -76.94 -29.29 55.57 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.278 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.736 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.97 -49.19 11.32 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.702 ' HD1' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -64.95 -54.91 23.12 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.621 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HG ' ' CZ ' ' A' ' 17' ' ' PHE . 5.7 mt -53.88 -33.98 58.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.2 0.524 . . . . 0.0 110.019 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -31.67 58.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.794 HD13 ' CG ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -70.36 -57.95 4.28 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.896 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.082 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.17 -42.8 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 CA-C-O 120.721 0.296 . . . . 0.0 110.434 178.424 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.74 -50.7 48.51 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.204 -0.998 . . . . 0.0 110.736 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -52.66 -36.7 49.28 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.768 178.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.917 HD21 ' HE3' ' A' ' 59' ' ' MET . 7.1 mt -63.64 -45.79 88.59 Favored 'General case' 0 CA--C 1.518 -0.27 0 O-C-N 122.692 -0.299 . . . . 0.0 110.452 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 88' ' ' HIS . . . -54.97 -32.02 61.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.32 0.581 . . . . 0.0 110.413 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.785 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.45 -17.58 9.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.347 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.84 13.66 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.379 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 1.7 t -154.4 -42.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 -179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.676 ' ND1' HD13 ' B' ' 14' ' ' ILE . 32.5 t-80 -87.67 150.19 23.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.927 0.394 . . . . 0.0 110.712 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.69 110.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.215 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.757 ' O ' HG12 ' B' ' 28' ' ' VAL . 1.3 m -178.94 -62.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.7 m-85 -115.11 -32.85 5.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.157 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t -44.54 139.01 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.593 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.22 39.87 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -167.76 -41.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.316 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.763 ' HB3' ' HD3' ' A' ' 96' ' ' PRO . . . -78.8 -53.14 1.21 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.486 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.763 ' HD3' ' HB3' ' A' ' 95' ' ' ALA . 75.5 Cg_exo -52.18 -47.76 25.14 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.666 2.244 . . . . 0.0 112.938 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 52.8 Cg_endo -69.5 -22.24 33.57 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.105 1.87 . . . . 0.0 112.511 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.59 117.61 16.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.15 -50.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.907 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -175.98 -51.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.928 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.854 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.824 0.345 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.419 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 0.3 OUTLIER 179.75 -51.33 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 23.9 Cg_exo -68.54 -132.6 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.041 2.494 . . . . 0.0 111.915 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.568 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER 175.24 150.73 0.11 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.436 0.636 . . . . 0.0 110.974 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.79 -49.22 10.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.395 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.832 HG23 ' CG1' ' A' ' 16' ' ' VAL . 4.0 m -64.14 -32.51 74.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.414 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.568 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.57 61.53 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.815 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' B' ' 12' ' ' SER . 0.0 OUTLIER -74.78 -26.84 60.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.44 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.57 ' HB3' HD22 ' A' ' 13' ' ' LEU . 73.7 m -68.17 -53.9 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.508 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.082 HG12 HD11 ' A' ' 80' ' ' ILE . 1.8 mp -50.71 -56.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.889 0.376 . . . . 0.0 111.339 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.9 OUTLIER -53.91 -27.73 32.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.864 -179.338 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.452 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.9 OUTLIER -61.9 -55.59 28.12 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 1.052 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.77 55.86 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.047 HD11 HG22 ' B' ' 10' ' ' ILE . 5.2 mt -49.65 -29.4 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 CA-C-O 121.09 0.471 . . . . 0.0 112.162 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.2 -31.86 21.52 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.827 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 1.052 HG22 ' O ' ' B' ' 13' ' ' LEU . 15.6 m -53.23 -33.86 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 177.108 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.747 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.74 -56.48 4.11 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.809 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.855 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 8.7 mm-40 -48.49 -26.12 2.0 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.442 -179.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -50.72 69.21 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.623 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -80.35 -50.38 10.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.919 0.866 . . . . 0.0 109.859 178.481 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -61.6 -52.11 65.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.888 -1.506 . . . . 0.0 112.173 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.19 -92.95 0.14 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.44 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 68.17 -68.35 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.851 0.358 . . . . 0.0 111.059 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -147.02 133.15 19.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.786 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.09 -28.44 12.85 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.511 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.89 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.847 0.356 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.16 167.81 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.876 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.757 HG12 ' O ' ' A' ' 90' ' ' SER . 29.9 m -98.15 26.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.285 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 8.1 p -149.2 -177.59 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.958 0.409 . . . . 0.0 111.119 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.623 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -141.49 -124.96 0.1 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.129 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.603 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -171.45 128.6 0.68 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.534 ' HG2' ' HE1' ' B' ' 60' ' ' MET . 19.6 mtmm -49.68 -41.18 42.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.64 -41.73 59.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.153 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.6 mt-10 -55.75 -28.8 57.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 0.0 110.376 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.36 -26.82 58.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.171 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.2 mm? -61.22 -59.16 5.75 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.568 0.699 . . . . 0.0 111.717 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 46.6 p -64.49 -51.15 64.43 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.694 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.555 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.8 m-85 -58.09 -50.87 71.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.99 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.771 ' HG2' HG21 ' B' ' 47' ' ' THR . 3.3 ttm -58.64 -27.06 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 110.5 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.74 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 13.6 m-20 -73.16 -19.39 61.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.77 -79.92 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.567 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.62 -46.33 63.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.13 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.719 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -111.2 38.49 2.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.272 0.558 . . . . 0.0 110.292 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.74 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.11 -30.27 58.18 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.826 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.29 -25.19 13.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.5 m-85 -109.44 23.76 14.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.006 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.771 HG21 ' HG2' ' B' ' 39' ' ' MET . 4.2 t -179.78 39.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.913 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.509 ' HB3' ' HB1' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -118.21 -35.85 3.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -163.09 30.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.883 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -71.28 158.47 36.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -28.38 65.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.962 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.625 ' HB3' HG23 ' B' ' 55' ' ' VAL . 0.5 OUTLIER -112.71 106.45 55.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.811 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -81.42 8.06 4.62 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.536 2.157 . . . . 0.0 112.846 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -106.97 -2.97 36.47 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.896 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.625 HG23 ' HB3' ' B' ' 52' ' ' ASP . 94.3 t -55.36 -53.27 37.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.711 0.291 . . . . 0.0 111.286 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.849 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -67.35 -52.31 41.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.126 0.489 . . . . 0.0 110.654 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.849 ' N ' HD23 ' B' ' 56' ' ' LEU . 3.8 t0 -59.01 -26.95 64.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.667 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.411 ' HA ' ' HG3' ' B' ' 61' ' ' LYS . 8.4 mmt85 -64.7 -43.23 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.051 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.991 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -60.94 -53.35 58.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 111.455 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.859 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -73.39 -31.7 64.04 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.017 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.476 ' HG3' ' H ' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -78.12 -51.51 10.15 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.838 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.476 ' H ' ' HG3' ' B' ' 61' ' ' LYS . 8.5 tmtm? -81.78 4.12 23.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.8 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.859 HD22 ' O ' ' B' ' 60' ' ' MET . 1.1 pt? -44.39 -30.07 0.78 Allowed 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.721 ' H ' HD23 ' B' ' 63' ' ' LEU . 31.0 t70 32.37 37.68 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.498 . . . . 0.0 112.289 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.756 HD22 ' O ' ' B' ' 63' ' ' LEU . 0.6 OUTLIER -159.81 24.07 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.213 -179.788 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 66' ' ' ASN . . . . . 0.756 ' HB3' HD11 ' B' ' 63' ' ' LEU . 53.5 p30 -60.8 -173.83 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.874 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 2.9 m -176.89 134.29 0.2 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -55.92 -23.33 30.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.947 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.73 -90.92 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.536 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.481 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 7.6 mm100 -149.33 -170.15 3.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.54 0.21 . . . . 0.0 111.039 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.737 HD12 ' HD1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -61.28 -129.62 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 9.4 t70 166.76 159.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.785 ' CG ' HG11 ' A' ' 85' ' ' VAL . 27.5 p90 -50.2 -58.71 5.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.951 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.49 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 7.1 tp-100 -76.95 -29.22 55.5 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.326 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.722 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.92 -49.2 11.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.737 ' HD1' HD12 ' B' ' 71' ' ' LEU . 0.1 OUTLIER -65.01 -54.85 23.86 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.616 179.281 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.485 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 5.6 mt -53.88 -34.0 58.15 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 110.031 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.423 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.0 OUTLIER -76.06 -31.71 58.94 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 177.84 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.8 HD13 ' CG ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -70.3 -57.92 4.33 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.977 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 1.006 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.18 -42.83 58.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 120.713 0.292 . . . . 0.0 110.38 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.63 49.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.167 -1.016 . . . . 0.0 110.758 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.481 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -52.73 -36.63 49.68 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.719 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.991 HD21 ' HE3' ' B' ' 59' ' ' MET . 7.1 mt -63.64 -45.9 88.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 O-C-N 122.698 -0.295 . . . . 0.0 110.449 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' B' ' 88' ' ' HIS . . . -54.97 -32.0 61.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.295 0.569 . . . . 0.0 110.429 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.786 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.63 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.443 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.81 13.67 17.24 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.307 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.433 ' N ' ' O ' ' B' ' 83' ' ' LEU . 1.7 t -154.4 -42.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.688 ' ND1' HD13 ' A' ' 14' ' ' ILE . 32.5 t-80 -87.67 150.08 23.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.822 0.344 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.65 110.61 0.53 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.23 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.76 ' O ' HG12 ' A' ' 28' ' ' VAL . 1.3 m -178.94 -62.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.7 m-85 -115.15 -32.8 5.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.057 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t -44.59 139.06 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.501 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.17 39.87 9.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.891 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -167.73 -41.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.399 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.771 ' HB3' ' HD3' ' B' ' 96' ' ' PRO . . . -78.78 -53.13 1.22 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.535 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.771 ' HD3' ' HB3' ' B' ' 95' ' ' ALA . 75.1 Cg_exo -52.3 -47.65 25.81 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.626 2.218 . . . . 0.0 112.935 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 53.2 Cg_endo -69.53 -22.24 33.43 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.15 1.9 . . . . 0.0 112.512 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.64 117.7 16.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.874 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.16 -50.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.991 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -176.0 -51.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.855 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.864 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.86 0.362 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 7' ' ' GLU . 0.5 OUTLIER -179.55 -50.16 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.114 179.925 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 13.2 Cg_exo -77.29 19.44 0.71 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.677 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -61.59 143.56 55.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.394 0.616 . . . . 0.0 111.23 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.49 -42.0 6.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.43 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.979 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -72.17 -41.74 66.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 109.998 179.188 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.677 ' HB2' HG23 ' A' ' 4' ' ' THR . 4.5 mm-40 -51.97 -45.85 64.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.984 0.421 . . . . 0.0 109.92 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -73.58 -26.62 60.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.584 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -64.55 -41.15 96.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.527 -179.507 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.979 HD12 ' O ' ' A' ' 6' ' ' THR . 3.4 mp -73.8 -51.31 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.955 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -51.83 -27.29 12.03 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.641 0.238 . . . . 0.0 111.641 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.578 ' O ' HG13 ' A' ' 16' ' ' VAL . 1.4 t -76.67 -55.73 5.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.653 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.48 65.16 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.955 HD12 ' HA ' ' A' ' 11' ' ' GLU . 20.1 mt -69.96 -41.53 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.865 0 CA-C-O 121.766 0.793 . . . . 0.0 110.741 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.486 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -73.99 -37.82 64.31 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.512 -175.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.847 HG22 ' O ' ' A' ' 13' ' ' LEU . 21.1 m -52.51 -36.99 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 121.731 0.777 . . . . 0.0 109.072 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.501 ' N ' HG23 ' A' ' 16' ' ' VAL . 2.9 t80 -80.52 -57.06 3.76 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 114.418 -1.265 . . . . 0.0 113.221 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.887 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.55 -24.48 62.8 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -52.16 64.19 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.415 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.629 ' OH ' HG21 ' A' ' 41' ' ' THR . 4.6 m-85 -80.51 -38.45 29.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.763 0.792 . . . . 0.0 109.473 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.887 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.16 -26.62 64.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.746 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -101.46 -104.12 2.72 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.519 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.2 73.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 110.781 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.27 37.25 14.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.74 104.32 0.21 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.556 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -70.9 139.47 50.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 0.0 110.933 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.2 p -175.69 165.67 3.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -107.3 31.96 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 18.1 p -155.33 -178.34 7.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -136.82 -123.86 0.14 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.101 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.57 ' N ' HD22 ' A' ' 30' ' ' LEU . 5.3 t -175.68 130.33 0.26 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.65 -41.41 42.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.011 0.434 . . . . 0.0 110.474 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 0.9 OUTLIER -61.95 -50.35 72.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.313 179.317 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.432 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -57.8 -37.13 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -73.4 -31.03 63.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.272 178.319 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.76 -59.36 5.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.454 0.645 . . . . 0.0 110.217 179.112 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.703 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -61.18 -26.94 68.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.672 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.513 ' CD2' ' CE1' ' A' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.59 85.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.746 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.47 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 1.1 mtp -69.11 -35.23 76.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.133 0.492 . . . . 0.0 110.354 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.5 -19.24 60.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.879 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.809 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.3 t -110.38 -37.27 5.56 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.809 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.7 mm-40 -128.16 -27.01 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -176.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.707 HD21 HD11 ' B' ' 10' ' ' ILE . 5.1 mt -112.07 44.29 1.43 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.526 0.679 . . . . 0.0 109.718 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -78.68 -25.63 44.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.906 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.38 -23.41 65.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.444 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.573 ' CD1' HD22 ' A' ' 43' ' ' LEU . 3.9 m-85 -86.11 -32.33 21.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.542 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.9 p -86.1 -34.14 20.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.177 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -58.87 -78.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.859 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.25 55.91 3.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.583 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -59.66 -50.48 73.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.064 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 25.2 tttt 56.29 24.26 8.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.466 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -177.22 120.9 0.27 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.508 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -83.13 15.98 1.97 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.564 2.176 . . . . 0.0 112.825 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.429 ' O ' ' CB ' ' A' ' 58' ' ' ARG . . . -118.02 9.84 13.82 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.624 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.757 HG22 ' HB1' ' A' ' 86' ' ' ALA . 68.0 t -84.64 -64.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.027 0.442 . . . . 0.0 111.072 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.01 -51.69 10.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.099 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 29.2 t70 -59.85 -35.76 75.42 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 54' ' ' GLY . 3.2 tpm_? -58.77 -52.3 66.3 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.656 ' HE1' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -75.34 -54.17 7.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.821 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.86 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -53.12 -29.81 33.07 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.613 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -78.75 -61.19 2.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 0.0 111.136 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 6.18 13.01 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.094 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.86 HD22 ' O ' ' A' ' 60' ' ' MET . 1.4 pt? -47.17 -22.84 0.42 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.494 ' H ' HD23 ' A' ' 63' ' ' LEU . 1.0 OUTLIER 76.65 52.91 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.977 0.417 . . . . 0.0 110.8 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.666 HD23 ' HG ' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -118.3 60.67 0.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.399 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -80.95 57.0 2.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.106 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.7 m 46.35 29.67 0.9 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.333 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.53 27.42 3.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.609 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 140.79 -101.23 0.29 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.481 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.637 ' C ' HD11 ' A' ' 65' ' ' LEU . 34.9 mm-40 -166.47 -167.83 1.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.723 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -62.42 -133.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.492 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 4.6 t0 177.19 -178.95 0.19 Allowed 'General case' 0 N--CA 1.461 0.1 0 O-C-N 121.811 -0.556 . . . . 0.0 110.985 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CD2' HG21 ' B' ' 85' ' ' VAL . 44.1 p90 -69.22 -55.89 9.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.328 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.566 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -80.5 -26.3 38.26 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.74 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.723 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -44.62 -35.94 2.83 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.274 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.525 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 2.1 t80 -77.87 -54.01 6.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.638 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.801 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.2 mt -57.85 -33.4 68.61 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.566 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.04 -49.23 18.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.366 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 1.058 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 5.6 mp -65.62 -61.5 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.863 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.57 ' CG1' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.86 -44.58 86.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.574 178.72 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.805 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -60.77 -50.24 69.7 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 178.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.565 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -58.86 -39.77 94.34 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.053 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 1.058 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.8 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 88' ' ' HIS . . . -58.79 -41.45 86.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.544 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.835 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -74.22 -17.29 16.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.321 -179.139 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.757 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -109.34 17.59 21.33 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.329 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.44 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.586 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.457 ' N ' ' O ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.71 2.53 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.465 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.661 ' HG2' HG23 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -178.86 -168.84 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 111.248 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 8.4 t -76.11 -27.39 57.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.661 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -53.96 52.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.757 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.49 HG12 ' NZ ' ' A' ' 99' ' ' LYS . 19.1 m -82.77 -24.75 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.248 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -13.36 55.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.417 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 90' ' ' SER . . . -82.15 -38.39 24.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.72 0.295 . . . . 0.0 111.193 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.706 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -133.01 52.56 8.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.284 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.485 ' HG2' ' HD3' ' A' ' 97' ' ' PRO . 1.1 Cg_endo -40.62 -58.42 0.99 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.364 2.709 . . . . 0.0 112.967 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.485 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 58.1 Cg_endo -70.39 -34.36 12.62 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.293 1.996 . . . . 0.0 112.02 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.706 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 5.8 mt-30 -79.15 103.56 9.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.873 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.49 ' NZ ' HG12 ' A' ' 92' ' ' VAL . 0.1 OUTLIER -142.44 -44.3 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.928 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -51.13 164.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.113 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.906 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.433 ' O ' ' CB ' ' B' ' 7' ' ' GLU . 0.5 OUTLIER -179.54 -50.05 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.118 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 13.2 Cg_exo -77.43 19.56 0.72 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.418 2.745 . . . . 0.0 113.326 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.702 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER -61.78 143.51 56.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.43 0.633 . . . . 0.0 111.223 -179.314 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.44 -42.03 6.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.339 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.972 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -72.1 -41.85 66.81 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.002 0.429 . . . . 0.0 109.989 179.197 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.702 ' HB2' HG23 ' B' ' 4' ' ' THR . 4.5 mm-40 -51.86 -45.82 64.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.021 0.439 . . . . 0.0 109.931 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -73.59 -26.67 60.92 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.611 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -64.58 -41.03 96.54 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.597 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 0.972 HD12 ' O ' ' B' ' 6' ' ' THR . 3.4 mp -73.92 -51.32 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.839 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 1.012 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -51.88 -27.17 11.91 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.909 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.579 ' O ' HG13 ' B' ' 16' ' ' VAL . 1.4 t -76.78 -55.75 5.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.523 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.822 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.44 65.13 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.012 HD12 ' HA ' ' B' ' 11' ' ' GLU . 20.2 mt -69.94 -41.48 79.49 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.876 0 CA-C-O 121.878 0.847 . . . . 0.0 110.838 178.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ALA . . . . . 0.486 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -74.05 -37.82 64.16 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 113.513 -1.676 . . . . 0.0 112.523 -175.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.822 HG22 ' O ' ' B' ' 13' ' ' LEU . 21.0 m -52.44 -36.97 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-O 121.718 0.77 . . . . 0.0 109.092 177.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.488 ' N ' HG23 ' B' ' 16' ' ' VAL . 2.9 t80 -80.44 -57.24 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.462 -1.245 . . . . 0.0 113.232 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.903 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.46 -24.49 62.89 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -177.456 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.17 64.2 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.378 -179.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.62 ' OH ' HG21 ' B' ' 41' ' ' THR . 4.6 m-85 -80.53 -38.44 29.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.796 0.808 . . . . 0.0 109.421 177.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.903 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.23 -26.57 65.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.746 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -101.47 -104.1 2.72 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.565 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.14 73.01 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 110.798 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.38 37.2 13.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.76 104.39 0.21 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.435 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -70.92 139.49 50.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 110.965 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -175.72 165.76 3.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 23.5 m -107.39 31.88 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.088 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.679 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 18.0 p -155.32 -178.37 7.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -136.78 -123.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.151 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.565 ' N ' HD22 ' B' ' 30' ' ' LEU . 5.3 t -175.66 130.28 0.26 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.675 0.274 . . . . 0.0 110.281 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -41.32 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 0.0 110.503 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 0.9 OUTLIER -62.07 -50.32 72.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.293 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 0.5 OUTLIER -57.85 -37.07 73.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.279 0.561 . . . . 0.0 109.6 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -73.38 -31.07 63.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.274 178.234 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.1 OUTLIER -58.79 -59.32 5.61 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.463 0.649 . . . . 0.0 110.226 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.694 ' O ' HG22 ' B' ' 41' ' ' THR . 0.3 OUTLIER -61.25 -26.9 68.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.659 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.503 ' CD2' ' CE1' ' B' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.53 85.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.748 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.556 ' HE3' ' HB3' ' B' ' 43' ' ' LEU . 1.1 mtp -69.2 -35.09 75.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.09 0.471 . . . . 0.0 110.369 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.56 -19.22 60.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.9 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.79 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.3 t -110.46 -37.19 5.56 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.79 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.7 mm-40 -128.21 -27.05 2.75 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.722 HD21 HD11 ' A' ' 10' ' ' ILE . 5.1 mt -111.97 44.2 1.44 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.415 0.626 . . . . 0.0 109.707 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -78.58 -25.68 45.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.948 -179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.34 -23.43 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.588 ' CD1' HD22 ' B' ' 43' ' ' LEU . 3.9 m-85 -86.05 -32.38 21.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.8 p -86.1 -34.18 20.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -58.94 -78.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.828 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.26 55.85 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.464 . . . . 0.0 110.579 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' B' ' 46' ' ' PHE . 1.7 mm-40 -59.56 -50.48 73.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.115 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 25.1 tttt 56.31 24.18 8.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.464 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -177.19 120.9 0.27 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.525 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -83.12 15.95 1.98 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.593 2.196 . . . . 0.0 112.759 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' B' ' 58' ' ' ARG . . . -118.09 9.94 13.66 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.56 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.761 HG22 ' HB1' ' B' ' 86' ' ' ALA . 67.3 t -84.71 -64.56 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.976 0.417 . . . . 0.0 111.163 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 5.5 tp -76.94 -51.84 10.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.093 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 29.2 t70 -59.74 -35.79 75.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.673 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.428 ' CB ' ' O ' ' B' ' 54' ' ' GLY . 3.2 tpm_? -58.77 -52.36 66.04 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.661 ' HE1' ' O ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -75.33 -54.12 7.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.831 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.885 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -53.14 -29.78 33.24 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.585 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -78.7 -61.2 2.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 0.0 111.207 179.438 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 6.2 12.95 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.167 -179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.885 HD22 ' O ' ' B' ' 60' ' ' MET . 1.4 pt? -47.19 -22.81 0.43 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.501 ' H ' HD23 ' B' ' 63' ' ' LEU . 1.0 OUTLIER 76.58 52.93 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.956 0.408 . . . . 0.0 110.793 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.664 HD23 ' HG ' ' B' ' 63' ' ' LEU . 0.6 OUTLIER -118.23 60.74 0.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.4 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.98 56.89 2.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.092 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.7 m 46.37 29.62 0.9 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.395 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.41 27.33 3.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.693 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.4 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . 140.77 -101.22 0.29 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.477 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.636 ' C ' HD11 ' B' ' 65' ' ' LEU . 34.8 mm-40 -166.54 -167.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.588 0.232 . . . . 0.0 110.414 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.71 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -62.55 -133.86 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.465 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 4.5 t0 177.2 -179.0 0.19 Allowed 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.473 0.579 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.835 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.8 p90 -69.07 -56.01 9.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.384 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -80.45 -26.24 38.46 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.821 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.721 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.66 -35.92 2.85 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.342 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 2.1 t80 -77.8 -54.15 6.67 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.629 178.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.805 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.2 mt -57.72 -33.58 68.57 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.0 OUTLIER -75.84 -49.34 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 1.068 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 5.6 mp -65.63 -61.43 2.09 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.872 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.564 HD11 ' CG1' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -57.87 -44.54 86.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.585 178.746 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.801 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -60.78 -50.35 68.58 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.569 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -58.79 -39.68 94.07 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.189 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 1.068 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.81 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' B' ' 88' ' ' HIS . . . -58.78 -41.44 86.66 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.64 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.837 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -74.16 -17.39 16.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.404 -179.259 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.761 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -109.25 17.67 21.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.458 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.45 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.526 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.496 ' N ' ' O ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.74 2.53 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.439 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.63 ' HG2' HG23 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -178.88 -168.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.322 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' B' ' 94' ' ' ALA . 8.4 t -76.12 -27.33 57.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.649 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -53.89 53.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.496 HG12 ' NZ ' ' B' ' 99' ' ' LYS . 19.1 m -82.78 -24.74 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.269 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.12 -13.36 55.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.481 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' B' ' 90' ' ' SER . . . -82.11 -38.36 24.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.776 0.322 . . . . 0.0 111.294 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.703 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -132.98 52.56 8.96 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.326 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.477 ' HG2' ' HD3' ' B' ' 97' ' ' PRO . 1.1 Cg_endo -40.7 -58.34 1.02 Allowed 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.408 2.739 . . . . 0.0 112.999 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.477 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 57.8 Cg_endo -70.42 -34.29 12.64 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.321 2.014 . . . . 0.0 112.091 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.703 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 5.9 mt-30 -79.15 103.58 9.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.85 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' LYS . . . . . 0.496 ' NZ ' HG12 ' B' ' 92' ' ' VAL . 0.1 OUTLIER -142.47 -44.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.985 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -51.13 164.34 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.132 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.929 -179.894 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.857 0.36 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.471 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -128.22 143.19 47.12 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 2' ' ' ARG . 38.5 Cg_exo -65.16 -128.88 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.976 2.45 . . . . 0.0 111.943 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -165.85 149.81 8.03 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.397 0.618 . . . . 0.0 110.865 -179.85 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.9 -47.64 11.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.528 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.91 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.6 m -66.79 -34.77 78.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.628 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.638 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.59 -39.19 57.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.704 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.11 -26.67 60.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.965 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.624 ' HB3' HD22 ' B' ' 13' ' ' LEU . 76.3 m -69.8 -52.65 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.034 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -58.26 -56.65 14.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.923 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.56 -27.07 15.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.518 -179.627 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -64.39 -55.88 18.05 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.907 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.959 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -74.25 -27.28 60.68 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.034 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -66.73 -35.95 76.05 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 O-C-N 121.73 -0.606 . . . . 0.0 110.824 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.86 61.17 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.25 -176.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.959 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -53.84 -36.18 29.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.471 0.653 . . . . 0.0 109.74 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.529 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -80.17 -60.04 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.725 -178.742 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.987 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 3.6 pt20 -66.7 -28.64 68.6 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.11 -50.99 57.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.948 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -79.67 -31.84 41.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.583 0.706 . . . . 0.0 109.562 178.022 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -71.55 -6.99 44.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 114.737 -1.12 . . . . 0.0 112.003 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -88.11 -169.69 45.37 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.501 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 mttt 59.82 63.89 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 110.908 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.42 -72.5 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.872 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.14 -89.06 0.11 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.591 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -100.78 166.17 11.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.792 0.33 . . . . 0.0 110.853 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.6 p 58.24 167.68 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' A' ' 29' ' ' THR . 3.3 m -107.75 -115.63 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.655 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p 54.09 163.22 0.01 OUTLIER 'General case' 0 C--N 1.339 0.143 0 CA-C-O 121.26 0.553 . . . . 0.0 111.637 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -114.98 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.13 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.523 ' N ' HD22 ' A' ' 30' ' ' LEU . 14.0 t 175.33 130.03 0.03 OUTLIER 'General case' 0 C--O 1.231 0.113 0 O-C-N 122.21 -0.306 . . . . 0.0 110.387 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -32.38 32.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.987 0.422 . . . . 0.0 110.757 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.588 ' HA ' HD12 ' A' ' 36' ' ' LEU . 1.0 OUTLIER -68.15 -48.61 64.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.024 179.291 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -28.74 70.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -70.8 -33.36 70.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.6 178.498 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.77 -59.73 4.97 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.502 0.668 . . . . 0.0 111.137 179.881 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.0 m -59.54 -34.02 72.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.06 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CE1' ' CB ' ' A' ' 42' ' ' GLU . 72.8 t80 -60.07 -55.02 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.676 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -58.57 -28.93 66.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.81 -19.77 60.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.88 -80.95 0.63 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' CB ' ' CE1' ' A' ' 38' ' ' PHE . 2.3 mm-40 -55.59 -24.31 32.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.46 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.957 HD21 HD11 ' B' ' 10' ' ' ILE . 11.4 mt -135.04 48.76 2.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.024 0.44 . . . . 0.0 110.838 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.41 -28.15 62.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.325 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.85 -24.75 62.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.636 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.623 ' HD2' HD22 ' A' ' 43' ' ' LEU . 66.8 m-85 -102.26 26.9 7.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.567 HG21 ' HG2' ' A' ' 39' ' ' MET . 5.0 t 179.25 38.27 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.773 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.401 ' HE2' ' HB2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -103.06 -37.1 7.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.988 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.401 ' HB2' ' HE2' ' A' ' 48' ' ' LYS . 2.7 t-20 -113.12 -13.31 13.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.039 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 55.9 56.94 5.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 111.183 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -68.14 -32.92 73.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.502 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -133.17 71.08 77.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.625 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.64 118.31 4.57 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.494 2.129 . . . . 0.0 112.219 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.472 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . 134.97 -35.38 2.2 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.29 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.663 HG12 HD22 ' A' ' 83' ' ' LEU . 94.2 t -47.72 -53.58 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 111.032 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.713 HD12 ' SD ' ' A' ' 39' ' ' MET . 5.5 tt -68.46 -52.62 30.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.433 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.442 ' N ' HD23 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -58.02 -33.4 68.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.212 -178.772 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.485 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -58.86 -54.18 50.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.251 . . . . 0.0 111.56 -179.134 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -76.48 -42.56 43.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.55 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -73.19 -54.76 7.66 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.618 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.425 ' HG2' ' N ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -70.66 -51.75 25.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.783 0.325 . . . . 0.0 111.254 -179.254 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -80.6 7.36 10.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.304 179.511 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.76 HD23 ' H ' ' A' ' 64' ' ' ASP . 1.0 OUTLIER -44.11 -27.85 0.43 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.18 -179.195 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.76 ' H ' HD23 ' A' ' 63' ' ' LEU . 1.2 m-20 37.85 64.57 0.66 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.842 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.641 HD21 HD12 ' A' ' 63' ' ' LEU . 68.6 mt -55.94 -70.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.904 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 43.87 29.86 0.34 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.598 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.2 t -98.44 -73.69 0.61 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.008 0.432 . . . . 0.0 110.623 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 p30 -143.41 34.47 1.31 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.198 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 63.85 35.25 91.77 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.905 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.504 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 2.4 mm100 -157.23 166.31 33.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.745 0.307 . . . . 0.0 111.202 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.531 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.26 -130.22 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 119.119 -0.467 . . . . 0.0 109.888 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.531 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.5 t0 175.31 -173.98 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.324 0.965 . . . . 0.0 112.375 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.849 ' CD2' HG21 ' B' ' 85' ' ' VAL . 43.5 p90 -83.2 -57.16 3.38 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.071 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.466 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 7.4 tp-100 -78.27 -30.76 48.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.422 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.862 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.61 -48.27 10.41 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.529 ' CB ' ' HB2' ' A' ' 17' ' ' PHE . 1.7 t80 -65.21 -52.95 51.49 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.298 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.425 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.1 mt -53.2 -38.96 63.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.145 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -36.61 58.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.862 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -61.5 -57.23 12.97 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.841 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.982 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.21 -44.8 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.802 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.468 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -52.75 -50.7 48.58 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -56.56 -31.26 60.07 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.225 -0.988 . . . . 0.0 111.525 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.834 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 16.6 mt -66.54 -44.77 81.49 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.73 -33.86 64.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.272 0.558 . . . . 0.0 110.776 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.855 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.96 9.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.736 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.62 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -115.13 14.31 16.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.189 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.63 -40.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.399 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.507 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.7 t-160 -93.4 177.99 5.86 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.876 0.37 . . . . 0.0 111.123 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.54 93.55 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.55 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 173.92 111.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.566 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.1 t80 68.69 -67.06 0.22 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.714 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.0 p -61.56 -24.2 33.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.1 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -23.31 26.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.184 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.92 19.14 9.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.464 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.785 ' HB3' ' HD3' ' A' ' 96' ' ' PRO . . . -102.46 -54.62 0.12 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.677 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.785 ' HD3' ' HB3' ' A' ' 95' ' ' ALA . 62.1 Cg_exo -54.1 -43.99 53.4 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.571 2.181 . . . . 0.0 112.892 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 97.6 Cg_endo -85.36 30.11 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.577 2.185 . . . . 0.0 112.904 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -158.64 31.32 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.76 35.1 3.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.76 -46.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.7 t80 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.927 179.956 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 32.3 p . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.843 0.354 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.464 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -128.25 143.17 47.06 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.862 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 2' ' ' ARG . 38.6 Cg_exo -65.19 -128.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.933 2.422 . . . . 0.0 111.874 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.632 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -165.84 149.89 8.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.414 0.626 . . . . 0.0 110.855 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -47.6 11.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.606 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.6 m -66.72 -34.79 78.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.678 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.632 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.56 -39.23 57.4 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.69 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.03 -26.74 60.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.983 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.627 ' HB3' HD22 ' A' ' 13' ' ' LEU . 78.5 m -69.87 -52.59 23.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.175 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.062 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -58.27 -56.68 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.764 0.316 . . . . 0.0 111.414 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.927 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.55 -27.07 15.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.452 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -64.41 -55.93 17.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.875 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.957 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -74.11 -27.34 60.83 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.062 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -66.77 -35.97 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-O 121.387 0.613 . . . . 0.0 110.785 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.8 61.19 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.228 -1.351 . . . . 0.0 112.331 -176.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.957 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.0 m -53.88 -36.12 29.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.467 0.651 . . . . 0.0 109.714 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.528 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -80.19 -60.11 2.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.865 -1.062 . . . . 0.0 112.654 -178.668 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.992 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 3.7 pt20 -66.74 -28.58 68.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.06 -50.93 57.72 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.48 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -79.74 -31.81 41.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 109.606 177.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.992 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -71.52 -6.98 44.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.009 -179.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -88.27 -169.6 45.2 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.545 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 mttt 59.73 64.0 1.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.954 0.407 . . . . 0.0 110.949 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.49 -72.55 0.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.18 -89.05 0.11 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.576 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -100.83 166.24 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 12.6 p 58.16 167.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.998 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' B' ' 29' ' ' THR . 3.4 m -107.75 -115.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.766 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.652 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p 53.93 163.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.126 0 CA-C-O 121.228 0.537 . . . . 0.0 111.676 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.61 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -115.04 0.31 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.108 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.527 ' N ' HD22 ' B' ' 30' ' ' LEU . 13.8 t 175.43 130.17 0.04 OUTLIER 'General case' 0 C--O 1.231 0.126 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.98 -32.33 33.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.762 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.595 ' HA ' HD12 ' B' ' 36' ' ' LEU . 1.0 OUTLIER -68.22 -48.58 64.76 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.952 179.335 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -28.65 70.02 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.522 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -70.84 -33.41 70.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.512 178.504 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.595 HD12 ' HA ' ' B' ' 33' ' ' THR . 0.2 OUTLIER -58.74 -59.72 4.96 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.431 0.634 . . . . 0.0 111.109 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -59.52 -34.03 72.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.086 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.446 ' CE1' ' CB ' ' B' ' 42' ' ' GLU . 73.1 t80 -60.09 -55.06 38.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.609 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.716 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.3 OUTLIER -58.61 -28.85 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.86 -19.72 60.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.821 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.95 -81.02 0.63 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.446 ' CB ' ' CE1' ' B' ' 38' ' ' PHE . 2.3 mm-40 -55.56 -24.24 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.496 -178.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.928 HD21 HD11 ' A' ' 10' ' ' ILE . 11.3 mt -135.11 48.79 2.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.794 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -27.99 62.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.367 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.7 62.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.722 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.609 ' HD2' HD22 ' B' ' 43' ' ' LEU . 67.0 m-85 -102.24 26.72 7.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.873 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.595 HG21 ' HG2' ' B' ' 39' ' ' MET . 5.0 t 179.38 38.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.768 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -37.05 7.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.967 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -113.09 -13.33 13.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.093 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 55.87 57.05 5.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.104 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -68.24 -32.81 73.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.53 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -133.21 71.05 77.44 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.599 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.59 118.33 4.58 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.619 2.212 . . . . 0.0 112.16 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . 134.81 -35.25 2.23 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.279 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.648 HG12 HD22 ' B' ' 83' ' ' LEU . 94.6 t -47.78 -53.51 4.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.94 0.4 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.716 HD12 ' SD ' ' B' ' 39' ' ' MET . 5.5 tt -68.59 -52.5 31.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.455 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.438 ' N ' HD23 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -58.09 -33.35 68.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.147 -178.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -58.82 -54.22 49.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.644 0.259 . . . . 0.0 111.502 -179.092 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -76.44 -42.63 43.35 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.545 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -73.21 -54.72 7.72 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.429 ' HG2' ' N ' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -70.64 -51.76 25.8 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.677 0.275 . . . . 0.0 111.279 -179.314 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' B' ' 58' ' ' ARG . 0.0 OUTLIER -80.61 7.36 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.301 179.487 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.762 HD23 ' H ' ' B' ' 64' ' ' ASP . 1.0 OUTLIER -44.05 -27.92 0.43 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.166 -179.235 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.762 ' H ' HD23 ' B' ' 63' ' ' LEU . 1.2 m-20 37.88 64.49 0.67 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.848 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.647 HD21 HD12 ' B' ' 63' ' ' LEU . 69.0 mt -55.9 -70.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.967 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 43.91 29.82 0.35 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.565 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.2 t -98.45 -73.66 0.61 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.647 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -143.49 34.64 1.3 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 63.72 35.3 91.84 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.01 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 2.4 mm100 -157.29 166.28 33.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.715 0.293 . . . . 0.0 111.227 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.53 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -65.2 -130.26 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.53 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 1.5 t0 175.28 -174.06 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.232 0.924 . . . . 0.0 112.256 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.855 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.3 p90 -83.19 -57.07 3.43 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.095 -179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.456 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 7.4 tp-100 -78.27 -30.8 48.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.444 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.859 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.63 -48.14 10.46 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.528 ' CB ' ' HB2' ' B' ' 17' ' ' PHE . 1.7 t80 -65.32 -52.86 51.21 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.32 178.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.1 mt -53.3 -38.93 63.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.964 0.411 . . . . 0.0 110.147 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -36.81 58.27 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.859 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -61.27 -57.35 12.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.891 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.1 -44.92 30.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 123.639 0.587 . . . . 0.0 110.76 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.487 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.66 -50.77 47.7 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.521 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -56.66 -31.17 60.26 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 120.197 -1.002 . . . . 0.0 111.505 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.833 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 16.8 mt -66.63 -44.73 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.65 -33.94 64.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.237 0.541 . . . . 0.0 110.787 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.849 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.95 9.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.793 -179.442 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.612 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -115.14 14.47 17.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.226 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.64 -40.5 0.05 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.443 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.8 t-160 -93.44 178.0 5.85 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 120.94 0.4 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.71 93.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.273 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.551 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 173.93 111.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.606 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.546 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.1 t80 68.67 -67.02 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.823 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.67 -24.1 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.131 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.53 -23.35 25.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.91 19.09 9.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.766 ' HB3' ' HD3' ' B' ' 96' ' ' PRO . . . -102.44 -54.7 0.12 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.595 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.766 ' HD3' ' HB3' ' B' ' 95' ' ' ALA . 59.9 Cg_exo -53.94 -44.06 52.61 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.694 2.263 . . . . 0.0 112.874 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 97.3 Cg_endo -85.43 30.15 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.554 2.169 . . . . 0.0 112.936 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -158.59 31.25 0.23 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.797 0.332 . . . . 0.0 110.81 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.8 35.15 3.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.85 -46.33 0.08 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 62.6 t80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.89 179.95 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.699 0.285 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.42 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 5.2 mtm105 -88.16 -51.24 0.4 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.976 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 29.9 Cg_exo -66.28 -129.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.089 2.526 . . . . 0.0 111.799 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -132.21 145.18 51.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.338 0.589 . . . . 0.0 111.207 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.03 10.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.101 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.992 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.52 -41.59 92.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.07 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.13 -35.72 36.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.498 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.67 -27.13 40.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.75 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.603 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.5 p -70.45 -41.37 72.93 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.296 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' A' ' 14' ' ' ILE . 2.9 mp -69.3 -54.95 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.731 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.994 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -51.84 -27.22 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.376 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 6.1 m -75.25 -55.83 5.32 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.84 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' B' ' 13' ' ' LEU . 3.9 mm? -61.13 -27.34 68.32 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' A' ' 10' ' ' ILE . 9.3 mt -71.8 -37.4 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 CA-C-O 121.505 0.669 . . . . 0.0 110.332 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.54 64.03 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.875 -177.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.838 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.4 m -53.8 -35.7 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.48 0.657 . . . . 0.0 109.479 178.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.491 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -80.33 -59.74 2.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.582 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.942 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 5.1 pt20 -69.91 -24.97 63.47 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -51.71 57.92 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.244 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.9 m-85 -80.19 -40.22 27.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.712 0.768 . . . . 0.0 109.41 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.942 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.85 -26.16 57.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.707 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -108.33 174.75 19.18 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.712 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.9 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.763 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -106.28 -32.16 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.935 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -166.25 -127.34 0.89 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -101.33 124.32 46.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.804 0.335 . . . . 0.0 110.887 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 t -114.77 160.89 18.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 p -108.98 -19.28 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.356 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.654 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.1 p -129.98 -176.87 4.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.753 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.657 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -137.81 -122.96 0.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.524 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.634 ' N ' HD22 ' A' ' 30' ' ' LEU . 18.5 t -179.82 127.9 0.09 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HE2' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.77 -40.69 42.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.18 -179.095 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.63 ' HA ' HD13 ' A' ' 36' ' ' LEU . 5.0 t -61.86 -43.51 98.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.459 ' N ' HG23 ' A' ' 33' ' ' THR . 15.7 mt-10 -61.52 -35.75 78.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.89 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -74.2 -29.9 61.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 176.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.84 -59.36 5.35 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.873 178.914 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -63.55 -41.19 98.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.489 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 t80 -60.02 -45.22 93.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.406 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.435 ' HE2' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -62.46 -31.28 71.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.788 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 18.7 m-80 -73.52 -19.74 60.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.39 -79.34 0.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.091 0.472 . . . . 0.0 111.862 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 2.7 mt-10 -52.07 -29.04 19.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.224 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' B' ' 10' ' ' ILE . 52.6 mt -130.41 50.14 2.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.099 0.476 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -79.2 -28.45 42.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.779 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.63 67.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.137 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.47 ' HD2' HD22 ' A' ' 43' ' ' LEU . 39.3 m-85 -102.06 27.2 6.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.962 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 65.0 p -150.35 -43.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.202 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -48.62 -79.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.377 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -106.63 78.46 1.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.004 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.421 ' NE2' ' SG ' ' A' ' 87' ' ' CYS . 18.1 mm100 -116.88 139.69 50.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.949 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.3 -31.37 16.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.907 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.483 ' HB3' HG23 ' A' ' 55' ' ' VAL . 1.2 t0 -83.54 110.62 25.81 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo -85.24 19.85 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.858 2.372 . . . . 0.0 112.738 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -122.68 14.79 8.56 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.625 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 86' ' ' ALA . 39.0 t -84.24 -61.22 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 59' ' ' MET . 7.7 tp -67.67 -51.16 53.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.96 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.84 -27.0 49.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -50.52 71.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.053 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.911 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.4 ptp -57.07 -53.52 57.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.277 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.872 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -58.73 -22.91 58.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.364 -179.534 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -78.56 -60.37 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.951 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.19 6.32 12.08 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 60' ' ' MET . 0.4 OUTLIER -73.58 -5.77 42.42 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.62 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.635 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.7 OUTLIER 64.31 -82.23 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.688 0.28 . . . . 0.0 110.593 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.863 HD23 ' HG ' ' A' ' 63' ' ' LEU . 0.3 OUTLIER 62.69 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.311 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 64' ' ' ASP . 14.4 m-20 64.39 19.71 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.072 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m 50.53 -175.29 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.126 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.91 24.64 6.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.847 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' A' ' 70' ' ' GLN . . . -156.87 -142.27 3.37 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.321 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.49 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 7.4 mm-40 -152.81 -174.98 5.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.779 0.323 . . . . 0.0 110.985 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.661 HD22 HD21 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -65.29 -131.38 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.932 179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.69 -168.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.879 0.763 . . . . 0.0 111.364 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.885 ' CG ' HG11 ' B' ' 85' ' ' VAL . 39.8 p90 -80.84 -60.51 2.28 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.894 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.464 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.1 -22.19 42.46 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.225 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.781 ' O ' HD13 ' A' ' 79' ' ' LEU . 2.1 tt0 -47.17 -32.66 4.55 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.531 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.3 t80 -80.51 -54.31 5.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.722 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' B' ' 77' ' ' LEU . 5.8 mt -53.75 -33.97 57.48 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.43 -40.71 49.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 177.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.7 mp -62.39 -57.64 10.55 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.03 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.891 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -75.21 -45.27 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.121 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.559 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.44 -48.87 53.87 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.47 -41.44 48.84 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.255 -0.974 . . . . 0.0 111.318 178.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.911 HD21 ' HE2' ' A' ' 59' ' ' MET . 9.1 mt -56.72 -47.65 79.49 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 110.661 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.62 -32.61 63.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.184 0.516 . . . . 0.0 111.27 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.27 -17.57 9.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.607 -179.411 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.652 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -112.5 2.21 16.22 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.368 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.492 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -137.6 -41.48 0.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 -179.934 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' B' ' 14' ' ' ILE . 0.7 OUTLIER -82.09 -166.64 1.29 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.887 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.87 36.4 1.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.312 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.618 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -99.53 7.56 45.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.779 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 177.92 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.386 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 93' ' ' LYS . 7.1 t -60.33 158.31 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.857 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.421 ' N ' HG12 ' A' ' 92' ' ' VAL . 0.0 OUTLIER 61.57 17.42 8.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.989 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 91' ' ' PHE . . . -117.36 -26.72 6.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.133 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.591 ' HB1' ' CB ' ' A' ' 98' ' ' GLN . . . -140.06 53.95 4.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.479 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.563 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 34.7 Cg_exo -59.34 -47.47 16.94 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.418 2.079 . . . . 0.0 112.713 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 97.7 Cg_endo -84.35 -23.49 2.85 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.633 2.222 . . . . 0.0 112.682 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.591 ' CB ' ' HB1' ' A' ' 95' ' ' ALA . 7.1 tm0? -50.05 149.8 2.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.301 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -121.84 102.37 8.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.879 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 -96.2 -34.85 11.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.927 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.745 0.307 . . . . 0.0 111.253 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.416 ' N ' ' CD ' ' B' ' 3' ' ' PRO . 5.2 mtm105 -88.16 -51.18 0.4 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.0 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.416 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 30.2 Cg_exo -66.38 -129.85 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.994 2.463 . . . . 0.0 111.813 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -132.2 145.13 51.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.246 0.546 . . . . 0.0 111.242 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.06 10.61 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.074 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.995 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.44 -41.62 93.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.192 0.52 . . . . 0.0 110.108 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.14 -35.71 37.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.539 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -27.25 41.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.803 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.618 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.5 p -70.33 -41.42 73.24 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.322 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.06 HG22 HD11 ' B' ' 14' ' ' ILE . 2.9 mp -69.32 -54.99 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.707 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -51.75 -27.29 11.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.336 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.559 ' O ' HG13 ' B' ' 16' ' ' VAL . 6.2 m -75.25 -55.92 5.23 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.764 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' A' ' 13' ' ' LEU . 3.9 mm? -61.03 -27.29 68.22 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.06 HD11 HG22 ' B' ' 10' ' ' ILE . 9.3 mt -71.86 -37.42 61.63 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 121.478 0.656 . . . . 0.0 110.336 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 -39.57 64.12 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.917 -177.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.827 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.4 m -53.76 -35.7 27.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.487 0.661 . . . . 0.0 109.479 178.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.487 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -80.28 -59.78 2.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.617 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.94 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 5.1 pt20 -69.92 -24.92 63.45 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -178.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -51.79 57.14 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.258 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.528 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.9 m-85 -80.2 -40.1 27.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.68 0.752 . . . . 0.0 109.413 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.94 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -57.01 -26.09 59.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.675 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -108.26 174.83 19.31 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.718 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.99 -40.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.782 0.325 . . . . 0.0 110.766 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -106.29 -32.22 8.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -166.16 -127.35 0.89 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.501 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -101.34 124.26 46.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.776 0.322 . . . . 0.0 110.946 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.8 t -114.74 160.86 18.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.8 p -108.96 -19.2 6.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.664 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.1 p -130.05 -176.86 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -137.8 -122.92 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.539 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.635 ' N ' HD22 ' B' ' 30' ' ' LEU . 18.8 t -179.88 127.84 0.08 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.495 ' HE2' HD11 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -49.58 -40.68 39.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.239 -179.149 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.626 ' HA ' HD13 ' B' ' 36' ' ' LEU . 5.0 t -61.99 -43.44 98.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.464 ' N ' HG23 ' B' ' 33' ' ' THR . 15.7 mt-10 -61.5 -35.65 78.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.896 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -74.32 -29.85 61.79 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 176.962 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.626 HD13 ' HA ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -57.81 -59.39 5.3 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.874 178.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.9 p -63.6 -41.16 98.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.411 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 9.0 t80 -60.08 -45.19 93.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.429 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.422 ' HE2' HD13 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -62.39 -31.39 72.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.824 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 18.9 m-80 -73.4 -19.72 60.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.242 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.45 -79.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.102 0.477 . . . . 0.0 111.777 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.7 mt-10 -52.02 -29.04 19.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.224 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.758 HD21 HD11 ' A' ' 10' ' ' ILE . 53.6 mt -130.33 50.09 2.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.039 0.447 . . . . 0.0 110.811 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -79.22 -28.41 42.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.01 -24.71 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.072 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.495 ' HD2' HD22 ' B' ' 43' ' ' LEU . 39.0 m-85 -102.08 27.26 6.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.96 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 65.4 p -150.36 -43.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.177 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -48.67 -79.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.38 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -106.67 78.42 1.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.004 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.428 ' NE2' ' SG ' ' B' ' 87' ' ' CYS . 18.2 mm100 -116.86 139.7 50.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.962 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.34 -31.35 16.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.821 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.479 ' HB3' HG23 ' B' ' 55' ' ' VAL . 1.2 t0 -83.55 110.67 26.18 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.94 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 52' ' ' ASP . 3.9 Cg_endo -85.31 19.88 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.866 2.377 . . . . 0.0 112.611 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -122.67 14.74 8.57 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.653 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 86' ' ' ALA . 39.0 t -84.17 -61.22 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.019 0.438 . . . . 0.0 111.094 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.453 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -67.74 -51.09 53.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.997 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -55.83 -26.96 49.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.32 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -50.42 72.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.008 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.933 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.4 ptp -57.13 -53.48 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.293 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.873 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -58.76 -22.91 59.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.399 -179.566 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -78.59 -60.39 2.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.931 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.16 6.35 11.96 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.873 HD22 ' O ' ' B' ' 60' ' ' MET . 0.4 OUTLIER -73.63 -5.73 42.24 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.603 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.633 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.7 OUTLIER 64.21 -82.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.654 0.264 . . . . 0.0 110.535 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.868 HD23 ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER 62.78 -76.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.216 179.562 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 66' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' B' ' 64' ' ' ASP . 14.3 m-20 64.42 19.68 11.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.024 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m 50.58 -175.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.81 0.338 . . . . 0.0 111.107 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 54.93 24.61 6.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.768 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . -156.83 -142.31 3.38 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.313 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.483 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 7.4 mm-40 -152.69 -174.9 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 110.913 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.682 HD22 HD21 ' B' ' 65' ' ' LEU . 0.3 OUTLIER -65.35 -131.4 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.931 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.446 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.2 OUTLIER 172.68 -168.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.939 0.791 . . . . 0.0 111.392 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CG ' HG11 ' A' ' 85' ' ' VAL . 39.9 p90 -80.92 -60.6 2.24 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.761 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.03 -22.25 42.6 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.21 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.1 tt0 -47.19 -32.66 4.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 178.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.2 t80 -80.48 -54.28 5.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.765 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' A' ' 77' ' ' LEU . 5.8 mt -53.79 -33.88 57.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.44 -40.73 49.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.896 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.7 mp -62.24 -57.67 10.59 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.07 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.91 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -75.24 -45.32 41.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.073 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.567 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.5 -48.86 54.28 Favored Glycine 0 C--N 1.333 0.4 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.508 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.43 -41.36 48.38 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.359 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.933 HD21 ' HE2' ' B' ' 59' ' ' MET . 9.2 mt -56.93 -47.55 80.37 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 120.676 0.274 . . . . 0.0 110.623 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.47 -32.81 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.199 0.523 . . . . 0.0 111.254 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.885 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.51 9.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.592 -179.332 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.638 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -112.48 2.17 16.22 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.418 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -137.59 -41.49 0.55 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' A' ' 14' ' ' ILE . 0.7 OUTLIER -82.06 -166.65 1.29 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.815 0.34 . . . . 0.0 110.919 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.76 36.35 1.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.346 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.619 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.0 OUTLIER -99.56 7.53 45.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.051 179.744 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.793 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 177.88 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.419 HG12 ' N ' ' B' ' 93' ' ' LYS . 7.4 t -60.38 158.35 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.799 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.419 ' N ' HG12 ' B' ' 92' ' ' VAL . 0.0 OUTLIER 61.55 17.41 8.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.002 -179.77 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 94' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 91' ' ' PHE . . . -117.39 -26.68 6.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.128 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.598 ' HB1' ' CB ' ' B' ' 98' ' ' GLN . . . -140.13 53.96 4.84 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.497 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.569 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 34.9 Cg_exo -59.27 -47.51 16.97 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.418 2.079 . . . . 0.0 112.701 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 96.6 Cg_endo -84.43 -23.32 2.87 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.517 2.145 . . . . 0.0 112.733 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.598 ' CB ' ' HB1' ' B' ' 95' ' ' ALA . 7.1 tm0? -50.06 149.72 2.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.318 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -121.71 102.32 8.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.889 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 -96.17 -34.91 11.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.9 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.827 0.346 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -99.68 167.82 10.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.45 -126.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.926 2.418 . . . . 0.0 111.835 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -177.44 149.11 0.62 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.544 0.688 . . . . 0.0 111.152 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.36 -48.98 13.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.417 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.952 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.3 m -64.34 -37.1 86.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.53 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.75 -38.25 54.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.727 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.87 -26.77 43.99 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.092 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HB3' HD22 ' B' ' 13' ' ' LEU . 63.9 m -69.23 -52.99 22.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.139 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -53.25 -56.15 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.541 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.44 -27.31 15.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.656 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.601 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -68.52 -55.9 10.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.805 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.96 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -68.68 -27.69 66.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -178.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.139 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -68.1 -36.34 75.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 O-C-N 121.666 -0.646 . . . . 0.0 110.508 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -32.65 41.89 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.482 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.2 m -51.73 -37.14 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.473 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.9 t80 -78.37 -58.54 3.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.319 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.788 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.5 mm-40 -49.13 -32.92 10.85 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.23 -51.96 67.59 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.876 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.1 m-85 -81.2 -47.69 13.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.778 0.799 . . . . 0.0 109.963 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.438 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -61.31 -17.03 51.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.887 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -75.32 143.15 30.22 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.491 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -165.54 -43.91 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.0 169.33 25.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.74 65.97 3.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.478 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -176.57 -39.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.773 0.32 . . . . 0.0 110.941 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -56.41 143.0 36.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.929 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 28' ' ' VAL . 14.3 p -145.99 24.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.38 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -143.38 150.84 39.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.144 0.497 . . . . 0.0 111.455 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -107.69 -152.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.961 179.264 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.451 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -148.52 147.62 29.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.207 0.527 . . . . 0.0 111.089 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.599 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.4 -44.76 68.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.755 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.056 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -74.62 -36.4 62.93 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.33 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -55.06 -30.63 60.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.391 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.514 ' CE2' ' HB3' ' A' ' 79' ' ' LEU . 2.3 t80 -81.21 -47.55 13.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.272 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 1.056 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -63.46 -28.08 69.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.783 0.325 . . . . 0.0 110.39 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.57 -28.38 33.86 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 20' ' ' TYR . 3.4 t80 -59.06 -54.79 43.09 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.983 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.568 ' HE2' ' HB3' ' A' ' 43' ' ' LEU . 2.8 mtp -48.8 -30.11 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.521 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -73.59 -19.47 60.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.186 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -105.11 -50.8 3.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.309 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.569 ' O ' HG21 ' B' ' 4' ' ' THR . 1.1 mm-40 -128.31 -12.55 5.07 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -177.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.945 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -117.48 46.71 1.66 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.353 0.597 . . . . 0.0 110.296 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.11 -30.54 27.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.993 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.43 -26.02 28.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.823 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -97.23 22.72 8.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.56 HG21 ' HB3' ' A' ' 39' ' ' MET . 26.2 p -147.4 -40.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.208 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -44.0 150.43 0.27 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.085 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.68 -54.69 0.67 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.95 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.28 64.57 0.1 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 111.085 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.35 10.34 31.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.941 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.642 ' O ' HG13 ' A' ' 55' ' ' VAL . 1.3 m-20 -138.57 68.26 45.06 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-O 120.93 0.395 . . . . 0.0 110.84 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -60.88 91.13 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.53 2.154 . . . . 0.0 112.023 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.58 -11.7 0.63 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.403 -0.903 . . . . 0.0 113.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.686 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m -77.44 -50.38 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 117.263 0.531 . . . . 0.0 110.53 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.48 ' N ' HG22 ' A' ' 55' ' ' VAL . 8.7 tp -68.99 -51.48 38.96 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.002 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.16 -28.72 69.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.212 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.61 73.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.821 0.344 . . . . 0.0 110.849 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE3' HD21 ' A' ' 83' ' ' LEU . 1.8 ptp -67.27 -53.44 29.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.138 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.585 ' O ' HD21 ' A' ' 65' ' ' LEU . 10.0 mmt -63.66 -22.83 67.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.31 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -55.57 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.43 -3.62 50.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.235 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.011 HD22 HD23 ' A' ' 65' ' ' LEU . 3.2 tt -68.01 -26.86 66.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.945 0.402 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 64.08 49.91 2.59 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.053 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 1.011 HD23 HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.84 -79.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.037 -179.767 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 61.13 32.06 19.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.866 0.365 . . . . 0.0 110.588 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.6 m 67.36 141.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 63.58 167.13 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.7 -40.62 2.6 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.436 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.537 ' O ' ' O ' ' A' ' 71' ' ' LEU . 5.4 mm100 62.96 156.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.389 0.138 . . . . 0.0 111.092 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.661 HD11 HD22 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -54.2 -130.62 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.571 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.596 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 3.8 p30 162.4 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.841 ' CG ' HG11 ' B' ' 85' ' ' VAL . 41.6 p90 -83.39 -58.62 2.75 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.54 ' O ' ' N ' ' A' ' 78' ' ' ASN . 7.6 tp-100 -80.33 -34.54 36.56 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' HG ' ' A' ' 71' ' ' LEU . 2.2 tt0 -44.49 -39.54 4.9 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.285 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.546 ' CD2' HD12 ' A' ' 30' ' ' LEU . 3.2 t80 -71.74 -52.86 15.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.749 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -55.62 -33.45 64.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -73.03 -40.3 65.25 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.852 HD11 ' HB2' ' A' ' 63' ' ' LEU . 1.8 mp -62.51 -57.13 12.26 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.543 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.074 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -70.45 -42.74 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 CA-C-O 120.828 0.347 . . . . 0.0 110.507 178.567 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.67 -50.58 48.57 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.413 -0.899 . . . . 0.0 110.895 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.74 -41.0 49.89 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.352 -0.927 . . . . 0.0 111.721 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE3' ' A' ' 59' ' ' MET . 4.0 mt -60.17 -46.79 88.51 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 122.634 -0.333 . . . . 0.0 110.787 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.13 58.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.093 0.473 . . . . 0.0 111.296 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.834 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.61 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.114 -178.8 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -117.66 8.46 12.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.963 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.82 -37.78 0.4 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.663 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.602 ' CD2' HD13 ' B' ' 14' ' ' ILE . 1.6 t60 -103.49 166.68 10.28 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.883 0.373 . . . . 0.0 111.06 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -59.75 115.7 3.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.64 -68.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.681 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.741 ' HB2' HG12 ' A' ' 85' ' ' VAL . 4.5 t80 -114.67 -32.56 5.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.749 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.37 -26.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.472 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.9 ttpp -92.44 16.57 11.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.5 22.35 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.157 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.954 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -124.82 72.73 62.87 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.439 ' N ' ' CD ' ' A' ' 97' ' ' PRO . 39.2 Cg_exo -58.92 -47.35 18.43 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.824 2.349 . . . . 0.0 112.819 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 84.3 Cg_endo -81.85 -28.51 2.08 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.412 2.075 . . . . 0.0 112.374 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.954 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 3.1 tt0 -57.4 90.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.93 -175.19 3.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.91 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.52 -64.41 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.983 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 7.8 t80 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.89 -179.986 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.839 0.352 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -99.64 167.87 10.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.9 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.53 -126.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.986 2.457 . . . . 0.0 111.825 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.681 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -177.43 149.0 0.62 Allowed 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.51 0.671 . . . . 0.0 111.229 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.3 -49.08 12.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.323 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.961 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.4 m -64.32 -37.04 86.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.51 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.681 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -38.19 54.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.768 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.91 -26.82 43.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.061 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB3' HD22 ' A' ' 13' ' ' LEU . 63.9 m -69.21 -52.93 22.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.244 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.11 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -53.19 -56.18 9.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.639 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.948 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.28 -27.52 15.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.757 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.614 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -68.5 -55.86 10.32 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.697 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.958 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -68.67 -27.76 66.27 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.11 HD11 HG22 ' B' ' 10' ' ' ILE . 7.6 mt -68.08 -36.4 75.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 O-C-N 121.724 -0.61 . . . . 0.0 110.446 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.58 -32.56 42.0 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.545 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.958 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.9 m -51.77 -37.12 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.467 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.8 t80 -78.39 -58.62 3.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.3 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.5 mm-40 -49.06 -32.94 10.48 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.16 -51.93 67.66 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.959 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.667 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.1 m-85 -81.17 -47.74 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.782 0.801 . . . . 0.0 109.952 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.422 ' HB2' ' CE1' ' B' ' 17' ' ' PHE . . . -61.43 -16.92 51.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.926 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -75.27 143.1 30.21 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.603 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -165.51 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.835 0.35 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -156.99 169.36 25.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.874 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.72 65.93 3.11 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.57 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -176.55 -39.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.341 . . . . 0.0 110.956 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -56.33 142.91 36.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.989 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 28' ' ' VAL . 14.2 p -145.9 24.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.396 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -143.39 150.83 39.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.211 0.529 . . . . 0.0 111.508 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.667 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -107.71 -152.33 0.48 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.91 179.361 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.45 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -148.49 147.51 29.19 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.128 0.489 . . . . 0.0 111.115 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.583 ' HG2' HD22 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -53.26 -44.81 68.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.751 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 33' ' ' THR . . . . . 1.004 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -74.61 -36.41 62.95 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.295 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.421 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -55.16 -30.59 60.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.521 ' CE2' ' HB3' ' B' ' 79' ' ' LEU . 2.3 t80 -81.28 -47.52 13.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.246 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 1.004 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.6 OUTLIER -63.42 -28.03 69.7 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 120.872 0.367 . . . . 0.0 110.509 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.55 -28.42 33.91 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.222 0.534 . . . . 0.0 109.641 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.498 ' CD2' ' CD1' ' B' ' 20' ' ' TYR . 3.4 t80 -58.95 -54.79 43.17 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.01 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.571 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 2.7 mtp -48.89 -30.17 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -73.55 -19.51 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' B' ' 38' ' ' PHE . 0.7 OUTLIER -105.08 -50.74 3.17 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -178.313 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.581 ' O ' HG21 ' A' ' 4' ' ' THR . 1.1 mm-40 -128.42 -12.5 5.01 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.991 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -117.63 46.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.294 0.568 . . . . 0.0 110.218 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.19 -30.53 27.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.989 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.39 -26.03 27.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -97.28 22.87 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.852 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.548 HG21 ' HB3' ' B' ' 39' ' ' MET . 26.6 p -147.55 -40.02 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.178 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -44.05 150.41 0.28 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.002 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.79 -54.8 0.67 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.902 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.33 64.67 0.1 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.102 0.477 . . . . 0.0 111.03 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.37 10.22 31.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.962 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.64 ' O ' HG13 ' B' ' 55' ' ' VAL . 1.3 m-20 -138.52 68.22 45.39 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-O 120.942 0.401 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -60.94 91.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.536 2.157 . . . . 0.0 111.976 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.49 -11.59 0.64 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.527 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.703 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m -77.5 -50.4 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 117.281 0.541 . . . . 0.0 110.489 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.478 ' N ' HG22 ' B' ' 55' ' ' VAL . 8.7 tp -69.05 -51.47 38.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.96 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.14 -28.69 69.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -35.57 73.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' MET . . . . . 1.072 ' HE3' HD21 ' B' ' 83' ' ' LEU . 1.8 ptp -67.23 -53.41 30.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.595 ' O ' HD21 ' B' ' 65' ' ' LEU . 10.0 mmt -63.7 -22.92 67.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.247 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -55.7 5.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.39 -3.58 50.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.237 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 1.049 HD22 HD23 ' B' ' 65' ' ' LEU . 3.2 tt -67.97 -26.87 66.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.028 0.442 . . . . 0.0 111.026 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 64.03 50.01 2.6 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.006 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 1.049 HD23 HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -74.83 -79.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.99 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 61.13 32.01 19.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.912 0.387 . . . . 0.0 110.677 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.6 m 67.35 141.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 63.56 167.1 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.73 -40.6 2.6 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.485 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.527 ' O ' ' O ' ' B' ' 71' ' ' LEU . 5.5 mm100 63.07 156.01 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.391 0.139 . . . . 0.0 111.043 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.664 HD11 HD22 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -54.3 -130.64 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.593 -179.685 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.598 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 3.7 p30 162.53 -148.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.834 ' CG ' HG11 ' A' ' 85' ' ' VAL . 41.7 p90 -83.38 -58.57 2.77 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.586 ' O ' ' N ' ' B' ' 78' ' ' ASN . 7.7 tp-100 -80.31 -34.59 36.65 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.615 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.2 tt0 -44.63 -39.39 4.99 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.296 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD2' HD12 ' B' ' 30' ' ' LEU . 3.2 t80 -71.72 -52.9 15.4 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.4 mt -55.56 -33.51 63.93 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -72.96 -40.35 65.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.897 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.86 HD11 ' HB2' ' B' ' 63' ' ' LEU . 1.8 mp -62.47 -57.22 12.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.472 179.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.989 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -70.43 -42.75 78.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.769 0.319 . . . . 0.0 110.497 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.67 -50.64 48.3 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.572 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.79 -40.95 50.17 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.37 -0.919 . . . . 0.0 111.725 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 1.072 HD21 ' HE3' ' B' ' 59' ' ' MET . 4.0 mt -60.09 -46.87 88.14 Favored 'General case' 0 C--N 1.332 -0.171 0 O-C-N 122.624 -0.339 . . . . 0.0 110.813 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.51 -29.1 58.25 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.089 0.471 . . . . 0.0 111.348 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.841 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.62 9.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.04 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -117.66 8.45 12.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.978 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.81 -37.81 0.4 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.655 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.61 ' CD2' HD13 ' A' ' 14' ' ' ILE . 1.6 t60 -103.5 166.61 10.32 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.922 0.391 . . . . 0.0 111.052 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.64 115.71 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.69 -68.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.703 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 4.5 t80 -114.58 -32.49 5.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.77 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.45 -26.15 5.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.505 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -92.34 16.5 11.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.143 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.48 22.32 3.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.157 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.903 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -124.81 72.69 62.66 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.148 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.438 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 40.2 Cg_exo -58.99 -47.28 18.52 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.695 2.263 . . . . 0.0 112.864 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 84.7 Cg_endo -81.79 -28.5 2.11 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 0.0 112.387 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.903 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 3.1 tt0 -57.42 90.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.02 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.84 -175.07 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.865 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -64.49 1.04 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 7.9 t80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.897 -179.993 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.772 0.32 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.13 76.23 73.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.826 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -63.7 -127.11 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.163 2.575 . . . . 0.0 112.167 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.596 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -145.69 152.09 39.07 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.359 0.6 . . . . 0.0 111.106 -179.783 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -44.84 -49.31 10.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.621 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.868 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.3 OUTLIER -62.53 -39.11 92.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.122 0.487 . . . . 0.0 109.894 178.996 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.596 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.63 -30.25 20.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.293 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -27.91 41.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.777 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 5.5 p -75.3 -41.79 56.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.261 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.026 HG22 HD11 ' A' ' 14' ' ' ILE . 1.9 mp -68.26 -53.81 26.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.869 0.366 . . . . 0.0 111.301 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.897 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -51.88 -27.29 12.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.101 -178.651 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' VAL . 9.1 m -73.65 -56.05 5.5 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.916 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.6 mm? -63.43 -28.76 70.19 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.026 HD11 HG22 ' A' ' 10' ' ' ILE . 14.4 mt -68.97 -38.53 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.881 0 CA-C-O 121.593 0.711 . . . . 0.0 110.894 179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -78.46 -31.38 47.89 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.786 -175.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.916 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.9 m -54.34 -40.77 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.624 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -81.71 -55.48 4.61 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -178.752 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.966 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -62.9 -24.76 67.99 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.733 -177.302 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -51.38 62.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 9.8 m-85 -81.38 -29.01 34.13 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.815 176.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.966 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -85.88 20.25 2.28 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.121 -178.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.17 -158.74 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.495 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp 63.73 36.26 10.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 0.0 110.917 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.35 166.93 7.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 120.66 -30.6 5.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.524 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -108.09 -30.8 8.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.852 0.358 . . . . 0.0 110.948 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.54 144.73 0.89 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.998 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.624 ' O ' HG13 ' A' ' 28' ' ' VAL . 7.1 p -91.17 81.29 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.886 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.2 p -154.25 160.99 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.196 0.522 . . . . 0.0 111.158 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.782 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -114.8 -116.73 0.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.009 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' A' ' 30' ' ' LEU . 23.1 t 179.98 130.16 0.09 Allowed 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.41 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 8.5 ttpt -49.73 -36.34 25.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.919 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.762 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -73.99 -45.25 51.09 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 4.2 mt-10 -55.92 -29.05 59.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.972 0.415 . . . . 0.0 110.276 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.23 -26.96 63.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.913 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.28 -58.87 5.92 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.663 0.744 . . . . 0.0 110.852 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.605 ' O ' HG22 ' A' ' 41' ' ' THR . 6.3 m -55.52 -44.95 77.15 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.815 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB ' ' A' ' 16' ' ' VAL . 50.8 t80 -57.86 -27.21 63.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.044 0.45 . . . . 0.0 110.449 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.729 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -74.15 -64.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.69 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.624 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 66.7 m-80 -56.61 -19.44 16.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.032 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 1.048 HG23 ' HG2' ' A' ' 42' ' ' GLU . 12.2 t -98.52 -26.48 14.41 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 1.048 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -129.9 -41.15 1.32 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.634 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' A' ' 39' ' ' MET . 14.0 mt -115.31 48.03 1.23 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.267 0.556 . . . . 0.0 110.046 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.624 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -84.5 -35.68 22.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.327 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.4 -22.72 8.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.878 0.371 . . . . 0.0 110.925 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 2.3 m-85 -88.98 -29.06 19.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.798 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.729 HG21 ' HG2' ' A' ' 39' ' ' MET . 2.1 t -131.99 47.22 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.849 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 44' ' ' ALA . 3.4 ptmt -93.77 -49.72 5.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.245 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -114.79 22.34 13.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 50.38 26.52 2.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.235 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.94 -34.49 68.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.01 0.433 . . . . 0.0 110.568 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.422 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . 2.5 m-20 -125.89 81.37 65.99 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.63 -10.77 29.49 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.504 2.136 . . . . 0.0 112.537 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -81.59 -24.26 56.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.704 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m -84.49 -53.66 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.987 0.422 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.706 HD13 ' N ' ' A' ' 57' ' ' ASP . 0.5 OUTLIER -59.72 -51.46 69.69 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.703 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.706 ' N ' HD13 ' A' ' 56' ' ' LEU . 35.9 t70 -67.81 -26.01 65.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.666 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.02 -33.61 69.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 0.0 110.567 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.868 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -75.11 -54.3 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.648 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.709 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 1.9 mtm -61.66 -40.18 94.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.774 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.13 -54.36 46.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.45 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.635 ' O ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -80.45 2.19 26.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.492 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.881 ' O ' HD13 ' A' ' 63' ' ' LEU . 1.9 tm? -46.04 -29.92 1.66 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.781 0.324 . . . . 0.0 111.298 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -67.05 74.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.959 0.409 . . . . 0.0 110.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.847 HD21 ' ND2' ' A' ' 78' ' ' ASN . 3.6 mm? -91.09 71.02 6.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.915 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 65.69 -76.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -56.66 131.53 49.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.949 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.3 126.21 55.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.863 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 123.86 -40.15 2.02 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.505 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 3.3 mm100 -133.92 169.4 17.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.75 0.309 . . . . 0.0 111.052 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.933 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.8 -133.53 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.725 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 20.7 t70 160.37 165.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 118.895 0.77 . . . . 0.0 111.121 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.632 ' CG ' HG11 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -46.46 -56.45 5.92 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.265 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.57 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 5.4 tp-100 -79.01 -33.25 45.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.521 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.933 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -44.79 -31.98 1.39 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HD1' HD12 ' A' ' 71' ' ' LEU . 1.5 m-85 -80.51 -54.76 5.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.708 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -61.69 -33.71 74.48 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.688 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.847 ' ND2' HD21 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -71.87 -36.62 70.15 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.696 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.3 mp -65.74 -57.75 7.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.764 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.978 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.65 -41.99 48.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.493 179.197 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.75 -49.99 51.52 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.77 -37.09 42.4 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 111.614 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.856 HD21 ' HE2' ' A' ' 59' ' ' MET . 5.4 mt -62.57 -47.49 83.62 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.807 0.337 . . . . 0.0 110.36 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.544 ' HB2' ' CG2' ' B' ' 10' ' ' ILE . . . -55.61 -30.8 61.53 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.361 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.627 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.19 -17.34 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.787 -178.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.687 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -115.44 7.69 15.08 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.622 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.442 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -145.8 -42.79 0.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.436 ' CD2' HG21 ' B' ' 10' ' ' ILE . 12.7 m-70 -85.83 176.44 8.1 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.51 2.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.494 ' O ' HG21 ' B' ' 28' ' ' VAL . 0.1 OUTLIER -170.54 -56.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.823 -179.909 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.427 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -125.33 -44.49 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.7 p -73.91 -24.32 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.295 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.18 -18.66 14.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.225 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 17.35 10.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.482 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.54 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -178.4 62.15 0.15 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.039 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.453 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 46.3 Cg_exo -57.79 -46.79 24.28 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.557 2.171 . . . . 0.0 112.58 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 84.7 Cg_endo -82.8 -2.64 10.97 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.45 2.1 . . . . 0.0 112.531 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.54 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -106.32 89.29 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.863 0.363 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.17 99.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -148.98 152.91 37.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 16.3 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.87 179.921 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.816 0.341 . . . . 0.0 111.289 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.12 76.17 73.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.774 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.68 -127.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.169 2.579 . . . . 0.0 112.127 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.592 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER -145.69 152.13 39.12 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.404 0.621 . . . . 0.0 111.018 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -44.9 -49.26 11.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.629 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.876 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.4 OUTLIER -62.62 -39.01 92.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.095 0.474 . . . . 0.0 109.889 179.027 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.592 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.74 -30.26 21.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.282 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.54 -27.8 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.8 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB2' HD22 ' A' ' 13' ' ' LEU . 5.6 p -75.3 -41.84 56.05 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.26 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.012 HG22 HD11 ' B' ' 14' ' ' ILE . 1.9 mp -68.24 -53.76 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.4 . . . . 0.0 111.354 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.914 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.5 OUTLIER -51.91 -27.27 12.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.075 -178.663 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.629 ' O ' HG13 ' B' ' 16' ' ' VAL . 8.9 m -73.71 -56.04 5.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.6 mm? -63.48 -28.67 70.12 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.012 HD11 HG22 ' B' ' 10' ' ' ILE . 14.5 mt -69.04 -38.38 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.884 0 CA-C-O 121.508 0.671 . . . . 0.0 110.881 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' ALA . . . . . 0.515 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -78.59 -31.34 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.113 -1.403 . . . . 0.0 112.744 -175.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.902 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.0 m -54.38 -40.77 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -81.72 -55.41 4.65 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -178.689 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.939 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -62.86 -24.82 67.99 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.69 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.33 -51.37 62.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.503 ' HB3' HD21 ' B' ' 30' ' ' LEU . 9.7 m-85 -81.38 -28.97 34.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.835 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.939 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -85.89 20.29 2.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.116 -178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.19 -158.63 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.55 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp 63.66 36.32 10.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.824 0.345 . . . . 0.0 110.922 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.53 167.1 7.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.847 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 120.59 -30.59 5.51 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.456 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -108.08 -30.8 8.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.845 0.355 . . . . 0.0 110.97 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.51 144.74 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.985 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.629 ' O ' HG13 ' B' ' 28' ' ' VAL . 7.1 p -91.14 81.25 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.941 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 9.3 p -154.25 160.96 42.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.261 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.76 ' HB2' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -114.84 -116.75 0.32 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.997 179.474 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' B' ' 30' ' ' LEU . 23.1 t -179.99 130.24 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.421 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 8.5 ttpt -49.83 -36.27 26.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.891 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.764 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.08 -45.26 50.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.481 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 4.2 mt-10 -55.9 -28.99 59.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.352 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.19 -27.04 63.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.881 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.764 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.27 -58.92 5.73 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.616 0.722 . . . . 0.0 110.825 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.607 ' O ' HG22 ' B' ' 41' ' ' THR . 6.2 m -55.49 -44.86 76.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.878 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.467 ' HA ' HG22 ' B' ' 41' ' ' THR . 50.6 t80 -58.01 -27.13 63.25 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.464 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.731 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -74.19 -64.48 1.01 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.762 179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.625 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 66.8 m-80 -56.57 -19.66 16.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.983 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' THR . . . . . 1.049 HG23 ' HG2' ' B' ' 42' ' ' GLU . 12.1 t -98.4 -26.36 14.5 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 1.049 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.2 OUTLIER -129.92 -41.19 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' B' ' 39' ' ' MET . 13.9 mt -115.35 48.07 1.23 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -84.58 -35.59 22.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.389 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.67 8.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.949 0.404 . . . . 0.0 111.008 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 2.4 m-85 -89.01 -29.0 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.782 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.731 HG21 ' HG2' ' B' ' 39' ' ' MET . 2.1 t -132.01 47.23 2.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' B' ' 44' ' ' ALA . 3.4 ptmt -93.81 -49.69 5.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.26 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -114.85 22.36 13.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.011 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 50.33 26.58 2.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.214 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.97 -34.57 68.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 0.0 110.563 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.42 ' HB3' ' CG1' ' B' ' 55' ' ' VAL . 2.5 m-20 -125.79 81.39 65.61 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.423 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.62 -10.78 29.54 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.573 2.182 . . . . 0.0 112.573 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -81.59 -24.3 56.5 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.731 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m -84.54 -53.51 10.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.858 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.695 HD13 ' N ' ' B' ' 57' ' ' ASP . 0.5 OUTLIER -59.74 -51.38 70.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.755 -179.535 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.695 ' N ' HD13 ' B' ' 56' ' ' LEU . 35.9 t70 -67.88 -26.08 65.83 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.575 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -57.93 -33.66 69.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.848 0.356 . . . . 0.0 110.607 -179.87 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.895 ' HE2' HD21 ' B' ' 83' ' ' LEU . 0.3 OUTLIER -75.18 -54.26 7.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.581 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.589 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 1.9 mtm -61.63 -40.25 94.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.9 OUTLIER -60.1 -54.27 47.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.486 179.587 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.641 ' O ' HD22 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -80.54 2.12 26.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.488 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.882 ' O ' HD13 ' B' ' 63' ' ' LEU . 1.9 tm? -45.98 -29.95 1.63 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.87 0.367 . . . . 0.0 111.269 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -67.03 74.3 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.833 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.835 HD21 ' ND2' ' B' ' 78' ' ' ASN . 3.6 mm? -91.11 71.11 6.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.854 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 65.73 -76.42 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.992 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -56.62 131.48 49.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.29 126.24 55.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 123.87 -40.17 2.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.567 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 3.3 mm100 -134.02 169.39 17.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 111.04 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.91 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.76 -133.48 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.728 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 20.7 t70 160.36 165.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 118.93 0.786 . . . . 0.0 111.079 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.627 ' CG ' HG11 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -46.43 -56.4 5.97 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.303 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.562 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 5.4 tp-100 -79.07 -33.25 44.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.489 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.91 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.3 OUTLIER -44.8 -31.97 1.4 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.872 0.368 . . . . 0.0 110.317 179.361 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.649 ' HD1' HD12 ' B' ' 71' ' ' LEU . 1.5 m-85 -80.49 -54.62 5.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.787 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -61.72 -33.76 74.6 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.716 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.835 ' ND2' HD21 ' B' ' 65' ' ' LEU . 0.1 OUTLIER -71.86 -36.7 70.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.762 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.862 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.3 mp -65.67 -57.7 7.45 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.74 -41.85 47.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.781 0.324 . . . . 0.0 110.496 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -49.95 52.3 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.439 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.74 -37.08 42.1 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.64 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.895 HD21 ' HE2' ' B' ' 59' ' ' MET . 5.4 mt -62.69 -47.43 83.68 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.548 ' HB2' ' CG2' ' A' ' 10' ' ' ILE . . . -55.62 -30.7 61.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.172 0.511 . . . . 0.0 111.461 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.632 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.37 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.785 -179.02 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.675 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -115.49 7.71 15.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.533 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.444 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -145.72 -42.78 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.009 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.8 m-70 -85.9 176.41 8.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.42 2.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.507 ' O ' HG21 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -170.45 -56.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.871 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.436 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -125.37 -44.45 1.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.878 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -73.94 -24.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.18 -18.66 14.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.262 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.82 17.47 10.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.469 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.544 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -178.46 62.1 0.15 Allowed Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.455 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 47.1 Cg_exo -57.72 -46.91 23.68 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.602 2.201 . . . . 0.0 112.53 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 84.3 Cg_endo -82.73 -2.66 11.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.409 2.073 . . . . 0.0 112.576 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.544 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.5 OUTLIER -106.26 89.31 3.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.906 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.14 99.53 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -148.98 152.99 37.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.889 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 15.9 t80 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.929 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.796 0.331 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -131.71 118.12 16.61 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.885 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.56 -101.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.699 2.266 . . . . 0.0 112.193 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.673 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -160.94 146.52 14.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.394 0.616 . . . . 0.0 111.207 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -44.04 9.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.348 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.849 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -68.67 -38.15 80.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.275 179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.673 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.2 OUTLIER -52.04 -37.13 52.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.68 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.38 -26.77 41.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.816 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.473 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.34 66.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.392 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.088 HG22 HD11 ' A' ' 14' ' ' ILE . 2.1 mp -61.01 -57.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.69 0.281 . . . . 0.0 111.066 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.906 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -53.84 -27.57 30.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.183 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.56 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -62.7 -55.5 26.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.781 -179.54 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.018 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -71.35 -41.76 69.36 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.088 HD11 HG22 ' A' ' 10' ' ' ILE . 5.0 mt -56.11 -29.33 26.97 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 CA-C-O 121.083 0.468 . . . . 0.0 112.128 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.14 -32.89 21.06 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.526 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.018 HG22 ' O ' ' A' ' 13' ' ' LEU . 14.2 m -54.7 -31.4 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.749 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.34 -58.09 3.3 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.335 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.9 mm-40 -48.5 -30.86 5.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.6 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -61.96 -51.36 68.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.866 0.365 . . . . 0.0 110.505 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.682 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -80.42 -32.95 37.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.748 0.785 . . . . 0.0 109.563 178.312 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.587 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . . . -90.4 19.9 4.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.854 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -164.9 -164.76 20.94 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.399 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -177.44 -66.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.811 0.338 . . . . 0.0 110.967 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -163.24 31.35 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.55 130.23 1.29 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.569 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.9 104.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 0.0 111.012 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -146.55 81.45 1.57 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.71 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 p -105.91 -23.94 4.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.402 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.26 -176.51 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.193 0.521 . . . . 0.0 111.357 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -135.38 -129.07 0.15 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.177 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.673 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -173.86 131.06 0.41 Allowed 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HB3' HD12 ' A' ' 63' ' ' LEU . 4.8 pttt -49.53 -42.58 44.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 0.0 110.619 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 1.058 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -75.2 -43.12 53.75 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.192 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.518 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.1 mt-10 -55.28 -28.87 56.39 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.402 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.7 19.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.091 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 1.058 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.7 62.12 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.089 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -81.4 -53.81 5.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.272 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -62.31 -36.02 80.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.296 179.494 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.577 ' HE2' HD13 ' A' ' 43' ' ' LEU . 4.2 ttm -46.67 -36.94 7.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.128 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.665 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 23.2 m-80 -64.0 -19.33 65.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.186 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.962 HG23 ' HG2' ' A' ' 42' ' ' GLU . 4.6 t -84.12 -30.71 25.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.962 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.0 OUTLIER -135.35 -38.01 0.76 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.191 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.83 HD21 HD11 ' B' ' 10' ' ' ILE . 19.0 mt -104.65 36.09 2.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.39 0.614 . . . . 0.0 110.146 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -79.4 -38.24 35.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.11 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.413 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . . . -53.75 -24.23 14.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.821 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.468 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 3.1 m-85 -100.27 27.11 5.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.784 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.5 p -152.11 -42.41 0.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.059 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HG2' ' HA ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -37.79 -83.82 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.708 -179.774 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -93.5 -56.17 3.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.964 0.411 . . . . 0.0 110.333 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.435 ' NE2' ' SG ' ' A' ' 87' ' ' CYS . 6.0 mm-40 55.18 168.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.522 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -108.33 -28.89 9.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.491 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.503 ' HB2' HG23 ' A' ' 55' ' ' VAL . 23.2 m-20 -121.08 116.09 31.37 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.777 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -66.03 -7.11 16.02 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.556 2.171 . . . . 0.0 112.683 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.75 -19.73 55.59 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.119 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.523 HG22 ' HB1' ' A' ' 86' ' ' ALA . 85.6 t -49.27 -54.85 5.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.968 0.384 . . . . 0.0 111.285 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.756 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -69.39 -51.61 34.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.298 0.57 . . . . 0.0 110.208 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.756 ' N ' HD23 ' A' ' 56' ' ' LEU . 2.9 t0 -54.6 -26.71 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.607 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.99 -53.03 62.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.663 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.859 ' CE ' HD21 ' A' ' 83' ' ' LEU . 2.5 ptp -60.54 -53.73 53.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.01 0.433 . . . . 0.0 110.456 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.67 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.3 mtm -60.32 -32.43 71.23 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.757 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.4 ' CG ' ' O ' ' A' ' 57' ' ' ASP . 8.2 mtpp -73.83 -57.35 4.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.881 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.8 mmtm -80.25 6.18 12.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.574 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.744 HD23 ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -58.97 -15.92 15.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.479 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.744 ' N ' HD23 ' A' ' 63' ' ' LEU . 13.5 t70 -67.99 66.33 0.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.931 0.395 . . . . 0.0 110.888 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.86 HD23 ' HG2' ' A' ' 75' ' ' GLU . 3.3 mm? -89.91 -44.93 9.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.374 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.08 108.81 6.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.768 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t -72.33 73.74 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.34 -28.82 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.012 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 134.28 -30.42 2.91 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.342 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 6.5 mm100 -122.39 -171.29 2.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.487 0.184 . . . . 0.0 110.609 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -63.71 -140.45 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.51 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.6 OUTLIER 165.61 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.256 0.55 . . . . 0.0 111.392 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.865 ' CD1' HG11 ' B' ' 85' ' ' VAL . 0.8 OUTLIER -46.05 -61.81 1.6 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.603 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.585 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.18 -30.43 38.81 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.267 -179.35 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.4 OUTLIER -46.58 -31.35 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.784 179.397 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.589 ' HB3' ' CD1' ' A' ' 17' ' ' PHE . 0.8 OUTLIER -79.36 -54.38 6.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.771 178.332 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.52 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 6.3 mt -61.07 -34.04 74.28 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.617 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.517 ' OD1' HD21 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -72.38 -34.57 68.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.054 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.847 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 0.3 OUTLIER -67.83 -57.83 5.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.685 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.973 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.27 -43.77 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.112 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.02 -50.35 51.66 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.81 -37.32 43.25 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.659 177.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.859 HD21 ' CE ' ' A' ' 59' ' ' MET . 7.6 mt -64.01 -45.46 88.85 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.737 0.303 . . . . 0.0 110.219 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 88' ' ' HIS . . . -55.25 -32.75 62.58 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.338 0.59 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CD1' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.48 9.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.666 -179.487 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -113.32 12.08 18.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.299 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.435 ' SG ' ' NE2' ' A' ' 50' ' ' GLN . 6.9 t -157.92 -39.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.677 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.468 ' NE2' ' CE2' ' A' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.61 12.26 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.774 0.321 . . . . 0.0 111.19 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.7 89.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.152 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.415 ' H ' HG22 ' A' ' 92' ' ' VAL . 1.1 m 176.55 107.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.664 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.752 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 75.88 -48.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 85' ' ' VAL . 31.2 m -44.41 -29.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.885 0.374 . . . . 0.0 111.654 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.94 -39.58 15.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.03 28.91 4.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.406 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.657 ' HB3' ' CD ' ' A' ' 96' ' ' PRO . . . -73.15 -65.82 0.63 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.162 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.657 ' CD ' ' HB3' ' A' ' 95' ' ' ALA . 1.9 Cg_endo -39.08 -55.52 1.43 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.38 2.72 . . . . 0.0 113.221 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.6 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 81.0 Cg_exo -42.71 -39.22 7.09 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.514 2.143 . . . . 0.0 112.731 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.58 -31.85 64.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.4 tttt 60.27 -169.0 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.835 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -149.38 174.79 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.915 -179.949 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.805 0.336 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -131.74 118.17 16.59 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.845 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.52 -101.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.807 2.338 . . . . 0.0 112.192 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.661 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -161.03 146.48 14.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.392 0.615 . . . . 0.0 111.171 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -43.95 9.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.326 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.853 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -68.77 -38.08 79.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.277 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.661 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.2 OUTLIER -52.12 -37.04 52.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.667 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -26.88 42.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.802 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.468 ' SG ' HG11 ' A' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.39 66.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.397 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.056 HG22 HD11 ' B' ' 14' ' ' ILE . 2.1 mp -60.96 -56.9 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 120.768 0.318 . . . . 0.0 111.132 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.904 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -54.0 -27.51 32.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.19 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -62.67 -55.54 25.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.817 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 1.024 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -71.37 -41.72 69.36 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.056 HD11 HG22 ' B' ' 10' ' ' ILE . 5.0 mt -56.1 -29.3 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 121.913 -0.492 . . . . 0.0 112.136 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.13 -32.84 21.09 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.554 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 1.024 HG22 ' O ' ' B' ' 13' ' ' LEU . 14.4 m -54.74 -31.4 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.74 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.28 -58.16 3.27 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.373 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.783 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.9 mm-40 -48.56 -30.73 5.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.622 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -62.06 -51.31 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.873 0.368 . . . . 0.0 110.495 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.679 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.31 -33.05 37.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.804 0.812 . . . . 0.0 109.631 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.599 ' HB2' ' HB2' ' B' ' 30' ' ' LEU . . . -90.42 20.04 4.8 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.213 -1.358 . . . . 0.0 111.743 -178.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -165.02 -164.75 21.05 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.406 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -177.44 -66.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.351 . . . . 0.0 110.994 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -163.25 31.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.58 130.35 1.3 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.541 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.77 104.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.86 0.362 . . . . 0.0 110.975 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -146.6 81.49 1.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 p -105.93 -23.91 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.361 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.22 -176.4 4.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.363 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.679 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -135.48 -129.14 0.15 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.183 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.67 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -173.82 131.04 0.42 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.525 ' HB3' HD12 ' B' ' 63' ' ' LEU . 4.8 pttt -49.49 -42.62 43.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.82 0.343 . . . . 0.0 110.643 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' THR . . . . . 1.017 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -75.18 -43.14 53.87 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.256 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.509 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.1 mt-10 -55.13 -28.98 56.62 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.401 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.72 19.44 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.038 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 1.017 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.84 62.15 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.987 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.409 ' N ' ' O ' ' B' ' 33' ' ' THR . 2.1 t -81.31 -53.8 6.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.309 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.883 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -62.44 -35.86 80.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.363 179.553 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.558 ' HE2' HD13 ' B' ' 43' ' ' LEU . 4.1 ttm -46.79 -36.87 7.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.005 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.659 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 23.2 m-80 -64.01 -19.46 65.2 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.952 HG23 ' HG2' ' B' ' 42' ' ' GLU . 4.5 t -83.94 -30.82 25.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.0 OUTLIER -135.4 -37.94 0.76 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -178.118 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.826 HD21 HD11 ' A' ' 10' ' ' ILE . 19.0 mt -104.68 36.07 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.41 0.624 . . . . 0.0 110.184 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.659 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -79.37 -38.23 35.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.14 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' ALA . . . . . 0.404 ' HA ' ' HG2' ' B' ' 48' ' ' LYS . . . -53.69 -24.32 14.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.805 179.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.459 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 3.1 m-85 -100.25 27.12 5.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.77 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 82.6 p -152.1 -42.42 0.11 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.042 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.404 ' HG2' ' HA ' ' B' ' 45' ' ' ALA . 0.0 OUTLIER -37.83 -83.88 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.691 -179.721 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -93.36 -56.22 3.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.968 0.413 . . . . 0.0 110.369 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.432 ' NE2' ' SG ' ' B' ' 87' ' ' CYS . 5.9 mm-40 55.27 168.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.462 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -108.34 -28.8 9.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.515 ' HB2' HG23 ' B' ' 55' ' ' VAL . 23.6 m-20 -121.09 116.22 31.29 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.762 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -66.06 -7.11 16.09 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.571 2.18 . . . . 0.0 112.649 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.76 -19.7 55.66 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.087 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.535 HG22 ' HB1' ' B' ' 86' ' ' ALA . 86.6 t -49.38 -54.84 5.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 117.019 0.409 . . . . 0.0 111.261 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.755 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -69.35 -51.72 34.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 110.175 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.755 ' N ' HD23 ' B' ' 56' ' ' LEU . 2.9 t0 -54.5 -26.85 33.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.9 -53.08 62.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.617 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.87 ' CE ' HD21 ' B' ' 83' ' ' LEU . 2.5 ptp -60.56 -53.8 53.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.373 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.699 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.2 mtm -60.26 -32.44 71.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.75 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.4 ' CG ' ' O ' ' B' ' 57' ' ' ASP . 8.2 mtpp -73.91 -57.32 4.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.4 ' O ' HD22 ' B' ' 65' ' ' LEU . 26.8 mmtm -80.24 6.21 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.585 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.743 HD23 ' N ' ' B' ' 64' ' ' ASP . 0.2 OUTLIER -59.02 -15.85 15.41 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.514 0.191 . . . . 0.0 111.514 -179.87 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.743 ' N ' HD23 ' B' ' 63' ' ' LEU . 13.5 t70 -68.05 66.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.919 0.39 . . . . 0.0 110.901 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.862 HD23 ' HG2' ' B' ' 75' ' ' GLU . 3.3 mm? -89.85 -44.9 9.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.361 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.06 108.88 6.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.804 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -72.38 73.82 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.005 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.34 -29.01 6.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.013 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 134.3 -30.31 2.93 Favored Glycine 0 C--N 1.33 0.221 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.299 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.467 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 6.4 mm100 -122.51 -171.21 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.485 0.183 . . . . 0.0 110.536 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 1.038 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -63.7 -140.45 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.506 ' O ' ' CE2' ' B' ' 76' ' ' PHE . 0.6 OUTLIER 165.66 175.7 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.177 0.513 . . . . 0.0 111.428 178.733 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CD1' HG11 ' A' ' 85' ' ' VAL . 0.9 OUTLIER -46.04 -61.8 1.6 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -177.639 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.582 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.29 -30.42 38.28 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.211 -179.266 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 1.038 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.4 OUTLIER -46.45 -31.49 2.72 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.873 179.331 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.593 ' HB3' ' CD1' ' B' ' 17' ' ' PHE . 0.8 OUTLIER -79.18 -54.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 120.462 -0.495 . . . . 0.0 109.818 178.242 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.526 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 6.3 mt -60.96 -34.02 74.11 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.716 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.516 ' OD1' HD21 ' B' ' 65' ' ' LEU . 0.1 OUTLIER -72.44 -34.55 67.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.043 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.829 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 0.3 OUTLIER -67.86 -57.82 5.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.645 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.981 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.23 -43.77 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.135 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.1 -50.34 52.0 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.438 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.86 -37.34 43.67 Favored Glycine 0 CA--C 1.52 0.405 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.633 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.87 HD21 ' CE ' ' B' ' 59' ' ' MET . 7.7 mt -64.02 -45.34 89.34 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.773 0.321 . . . . 0.0 110.253 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.457 ' HA ' ' CD2' ' B' ' 88' ' ' HIS . . . -55.32 -32.78 62.76 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.3 0.572 . . . . 0.0 110.663 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.865 HG11 ' CD1' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.34 -17.29 9.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.727 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.535 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -113.41 12.1 18.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.368 -179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.432 ' SG ' ' NE2' ' B' ' 50' ' ' GLN . 6.9 t -157.89 -39.66 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.678 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.459 ' NE2' ' CE2' ' B' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.63 12.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.819 0.343 . . . . 0.0 111.143 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.69 89.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.154 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.409 ' H ' HG22 ' B' ' 92' ' ' VAL . 1.1 m 176.54 107.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.626 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.749 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 75.91 -49.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.156 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.441 HG13 ' O ' ' B' ' 85' ' ' VAL . 30.9 m -44.38 -29.55 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.862 0.363 . . . . 0.0 111.663 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -39.58 15.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.093 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.04 28.88 4.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.381 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.656 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . . . -73.1 -65.79 0.64 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.216 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.656 ' CD ' ' HB3' ' B' ' 95' ' ' ALA . 1.9 Cg_endo -39.12 -55.52 1.44 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.483 2.789 . . . . 0.0 113.193 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.599 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 80.6 Cg_exo -42.78 -39.24 7.26 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.648 2.232 . . . . 0.0 112.689 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -31.94 64.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.5 tttt 60.29 -168.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.861 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -149.34 174.76 12.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.876 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.203 -0.904 . . . . 0.0 110.894 -179.996 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.787 0.327 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.449 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -135.77 91.12 18.24 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 2' ' ' ARG . 22.7 Cg_endo -55.62 -83.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.915 2.41 . . . . 0.0 112.832 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.641 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -109.93 146.64 34.86 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.482 0.658 . . . . 0.0 111.392 -179.804 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 6' ' ' THR . 0.7 OUTLIER -45.01 -48.24 11.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.303 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.9 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.7 m -65.26 -39.7 92.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.385 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.641 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.3 mm-40 -51.76 -45.91 63.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.498 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -26.78 60.93 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.569 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -63.6 -52.31 61.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.956 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -55.69 -57.12 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 120.694 0.283 . . . . 0.0 111.056 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.881 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.8 OUTLIER -54.59 -27.42 38.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.025 0.44 . . . . 0.0 110.756 179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.789 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.07 -55.51 24.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.081 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' B' ' 13' ' ' LEU . 4.0 mm? -72.14 -30.97 65.55 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.022 HD11 HG22 ' A' ' 10' ' ' ILE . 5.5 mt -69.8 -38.25 75.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 111.95 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.65 64.06 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.678 -1.147 . . . . 0.0 112.023 -176.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.9 m -52.27 -40.0 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.506 ' N ' HG23 ' A' ' 16' ' ' VAL . 31.3 t80 -72.85 -58.21 3.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.296 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.793 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.0 mm-40 -49.09 -49.02 43.74 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -51.28 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.525 -178.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.502 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.6 m-85 -80.59 -26.87 37.61 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.59 0.709 . . . . 0.0 110.206 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.748 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -90.39 20.07 4.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.781 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -121.21 90.81 0.46 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.556 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.39 43.3 2.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.845 0.355 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.45 114.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.07 156.1 28.05 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.552 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 66.08 -75.55 0.05 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.789 0.328 . . . . 0.0 111.014 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 61.22 19.38 10.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.232 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.8 m -144.25 17.63 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.361 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.748 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 24.1 p -155.17 -176.91 6.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.989 0.423 . . . . 0.0 110.812 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 31' ' ' SER . 0.3 OUTLIER -147.78 -123.16 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.261 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.551 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -173.7 129.23 0.41 Allowed 'General case' 0 C--O 1.231 0.088 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.408 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -49.91 -40.71 44.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.165 -179.136 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.711 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.44 -42.72 67.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.936 0.398 . . . . 0.0 110.041 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.0 mt-10 -56.01 -29.65 60.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -68.62 -34.88 76.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.535 178.441 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -53.37 -59.08 5.03 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.699 0.761 . . . . 0.0 111.192 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' HG22 ' A' ' 41' ' ' THR . 3.0 t -57.88 -27.75 63.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.34 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' B' ' 6' ' ' THR . 8.7 t80 -57.69 -50.39 73.35 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.012 0.434 . . . . 0.0 110.267 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.719 ' HE3' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.39 -44.14 95.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.444 0.64 . . . . 0.0 110.107 179.05 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.44 -19.29 64.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.932 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 37' ' ' SER . 8.3 t -107.61 -52.69 2.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' N ' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -128.09 29.2 5.42 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -177.149 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.719 HD13 ' HE3' ' A' ' 39' ' ' MET . 7.8 mt -166.7 45.8 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.17 0.51 . . . . 0.0 110.604 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.427 ' O ' ' N ' ' A' ' 48' ' ' LYS . . . -74.87 -30.0 61.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.361 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.47 -29.49 61.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.879 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CD1' HD22 ' A' ' 43' ' ' LEU . 4.4 m-85 -83.28 -4.63 58.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.702 HG21 ' HB3' ' A' ' 39' ' ' MET . 1.4 p -127.16 -11.23 5.86 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.668 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 44' ' ' ALA . 9.2 mttp -59.59 139.75 56.92 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 110.758 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 78.81 -47.83 0.42 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.005 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.17 26.71 4.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 110.98 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -66.54 -31.99 73.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.512 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.93 86.69 9.29 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.657 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -83.41 37.58 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.838 2.359 . . . . 0.0 112.835 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.575 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -135.54 4.33 4.03 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.947 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' A' ' 86' ' ' ALA . 48.9 t -85.22 -63.5 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.918 0.39 . . . . 0.0 111.523 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.665 HD23 ' C ' ' A' ' 56' ' ' LEU . 7.0 tt -75.16 -52.15 11.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.969 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 1.6 t0 -55.48 -26.81 44.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.028 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.575 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -66.57 -53.79 30.68 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -179.329 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.696 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -75.55 -43.09 50.41 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.11 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.678 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -64.43 -45.38 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.664 -179.251 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 47.0 mmtt -70.53 -52.06 24.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.98 0.419 . . . . 0.0 110.479 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -80.36 6.47 12.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.341 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.678 HD22 ' O ' ' A' ' 60' ' ' MET . 1.2 pt? -44.7 -26.65 0.4 Allowed 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.648 ' H ' HD23 ' A' ' 63' ' ' LEU . 2.3 p30 -70.94 64.51 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.889 0.376 . . . . 0.0 110.48 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.584 HD23 ' C ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -103.63 -39.59 6.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.031 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -115.67 -40.41 3.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.35 -178.64 5.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.765 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -146.13 34.15 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.883 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.31 -79.6 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.505 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 3.5 mm100 -87.33 179.63 6.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.891 0.377 . . . . 0.0 111.109 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.588 HD22 HD12 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -69.37 -137.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.635 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 2.5 t70 173.72 161.49 0.16 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.466 0.575 . . . . 0.0 110.879 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.939 ' CD2' HG11 ' B' ' 85' ' ' VAL . 51.5 p90 -55.39 -58.85 6.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.289 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -79.96 -22.59 42.44 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 119.824 -0.751 . . . . 0.0 110.516 -179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.5 mt-10 -44.76 -38.09 4.22 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.506 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 1.4 t80 -76.84 -54.71 6.25 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 177.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' B' ' 77' ' ' LEU . 0.0 OUTLIER -48.55 -33.94 10.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.899 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.599 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -76.38 -52.39 9.99 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.686 178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.978 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -58.5 -59.07 5.95 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.951 -179.073 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.24 -41.41 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 O-C-N 123.606 0.566 . . . . 0.0 111.212 179.492 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.459 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.83 -50.82 48.55 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 119.68 -1.247 . . . . 0.0 110.22 178.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -60.71 -35.91 90.66 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 120.455 -0.879 . . . . 0.0 111.846 177.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.978 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.8 mt -63.92 -38.32 90.66 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.3 -35.73 65.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.095 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.938 HG11 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.81 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.67 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -113.86 16.14 18.46 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.163 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.406 ' N ' ' O ' ' A' ' 83' ' ' LEU . 45.1 t -162.76 -42.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.825 -179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -99.01 78.78 2.29 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 111.855 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 90' ' ' SER . 6.0 mp0 53.37 -163.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.292 179.244 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 3.2 m 81.7 -69.56 0.08 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.247 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.57 -37.52 4.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.054 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 92' ' ' VAL . 4.2 m -65.29 -27.08 41.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.42 -29.01 15.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.89 -30.18 70.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.116 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -154.86 66.85 5.15 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.037 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.455 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 50.7 Cg_exo -57.49 -47.16 23.04 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.761 2.308 . . . . 0.0 112.569 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 98.0 Cg_endo -79.96 -25.34 5.19 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.358 2.039 . . . . 0.0 112.368 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.746 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -67.75 85.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.933 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.65 168.04 2.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.7 -62.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.805 0.336 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.444 ' HA ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -135.74 91.1 18.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.921 179.984 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' B' ' 2' ' ' ARG . 22.3 Cg_endo -55.74 -83.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.905 2.403 . . . . 0.0 112.834 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.651 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -109.85 146.51 34.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.429 0.633 . . . . 0.0 111.476 -179.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 5' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' B' ' 6' ' ' THR . 0.7 OUTLIER -44.96 -48.25 11.4 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.255 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 20.1 m -65.31 -39.69 92.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.326 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.651 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.74 -45.87 63.83 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.458 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -26.77 60.86 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.563 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -63.48 -52.41 61.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.032 179.791 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.124 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -55.6 -57.07 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.638 0.256 . . . . 0.0 111.117 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.8 OUTLIER -54.67 -27.43 40.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 110.729 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.804 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.05 -55.52 24.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.084 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' A' ' 13' ' ' LEU . 4.0 mm? -72.16 -31.02 65.56 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.124 HD11 HG22 ' B' ' 10' ' ' ILE . 5.6 mt -69.8 -38.2 75.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.344 0.592 . . . . 0.0 111.902 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.18 -34.58 63.82 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.963 -176.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' B' ' 13' ' ' LEU . 16.0 m -52.27 -40.07 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 177.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.502 ' N ' HG23 ' B' ' 16' ' ' VAL . 31.4 t80 -72.77 -58.1 3.6 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.422 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.0 mm-40 -49.32 -48.84 46.04 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.28 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.66 -51.25 22.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.511 -178.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.521 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.6 m-85 -80.53 -26.9 37.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.521 0.677 . . . . 0.0 110.144 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -90.4 20.03 4.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.705 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -121.11 90.73 0.46 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.594 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.5 43.43 2.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.411 . . . . 0.0 110.911 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.27 114.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.971 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.09 156.0 28.01 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.646 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 66.09 -75.66 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.719 0.295 . . . . 0.0 110.972 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 61.37 19.34 10.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.6 m -144.21 17.69 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.402 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.744 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 24.2 p -155.16 -176.98 6.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.016 0.436 . . . . 0.0 110.839 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.558 HD22 ' N ' ' B' ' 31' ' ' SER . 0.3 OUTLIER -147.74 -123.2 0.06 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.31 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.558 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.3 OUTLIER -173.66 129.21 0.42 Allowed 'General case' 0 C--O 1.231 0.116 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.32 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.413 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -49.8 -40.79 42.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.19 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.722 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.34 -42.77 68.12 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.075 179.591 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.511 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.0 mt-10 -55.92 -29.77 60.58 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -68.57 -34.86 76.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.521 178.525 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.722 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -53.4 -59.12 4.99 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 111.123 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.525 ' O ' HG22 ' B' ' 41' ' ' THR . 3.0 t -57.84 -27.74 63.47 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.386 -178.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' A' ' 6' ' ' THR . 8.6 t80 -57.64 -50.49 72.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.979 0.418 . . . . 0.0 110.26 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.698 ' HB3' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -60.32 -44.07 95.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.438 0.637 . . . . 0.0 110.147 179.064 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -63.5 -19.29 64.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.92 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.525 HG22 ' O ' ' B' ' 37' ' ' SER . 8.2 t -107.68 -52.59 2.74 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.451 ' N ' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -128.16 29.2 5.41 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.158 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.667 HD13 ' HE3' ' B' ' 39' ' ' MET . 7.8 mt -166.7 45.81 0.06 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.138 0.494 . . . . 0.0 110.604 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' B' ' 48' ' ' LYS . . . -74.83 -29.95 61.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.431 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.49 -29.5 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.856 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.42 ' CD1' HD22 ' B' ' 43' ' ' LEU . 4.4 m-85 -83.32 -4.61 58.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.201 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.698 HG21 ' HB3' ' B' ' 39' ' ' MET . 1.4 p -127.1 -11.19 5.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.705 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' B' ' 44' ' ' ALA . 9.3 mttp -59.55 139.7 56.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 78.84 -47.84 0.42 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.16 26.71 4.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.001 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -66.56 -32.07 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.89 86.63 9.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.645 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.43 37.65 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.799 2.333 . . . . 0.0 112.809 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.585 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -135.56 4.32 4.02 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.964 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' B' ' 86' ' ' ALA . 49.1 t -85.27 -63.42 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 0.0 111.534 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.655 HD23 ' C ' ' B' ' 56' ' ' LEU . 7.0 tt -75.11 -52.23 11.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.976 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 1.6 t0 -55.52 -26.77 44.91 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.02 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -66.59 -53.75 31.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.705 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -75.53 -43.09 50.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.172 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.676 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -64.47 -45.28 88.04 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.683 -179.234 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 47.1 mmtt -70.61 -52.04 24.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -80.42 6.55 11.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.676 HD22 ' O ' ' B' ' 60' ' ' MET . 1.2 pt? -44.68 -26.63 0.4 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.654 ' H ' HD23 ' B' ' 63' ' ' LEU . 2.3 p30 -70.97 64.5 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.934 0.397 . . . . 0.0 110.469 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.578 HD23 ' C ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER -103.71 -39.48 6.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.047 -179.711 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -115.7 -40.53 3.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.18 -178.57 5.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.84 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -146.18 34.11 0.99 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.855 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.18 -79.59 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.552 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.499 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 3.5 mm100 -87.29 179.56 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.88 0.372 . . . . 0.0 111.167 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.577 HD22 HD12 ' B' ' 63' ' ' LEU . 0.4 OUTLIER -69.25 -137.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 2.5 t70 173.69 161.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.409 0.55 . . . . 0.0 110.969 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.938 ' CD2' HG11 ' A' ' 85' ' ' VAL . 51.6 p90 -55.37 -58.83 6.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.4 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.584 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -79.92 -22.55 42.59 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.556 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.823 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.5 mt-10 -44.81 -38.11 4.29 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 1.4 t80 -76.77 -54.71 6.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -48.6 -33.85 10.54 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 177.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.0 OUTLIER -76.48 -52.36 9.96 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.654 178.027 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.973 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -58.55 -58.94 6.35 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.977 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.97 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.27 -41.53 65.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 O-C-N 123.572 0.545 . . . . 0.0 111.158 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.72 -50.82 47.87 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 119.75 -1.215 . . . . 0.0 110.261 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.49 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -60.77 -35.88 90.77 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.847 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.973 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.9 mt -63.87 -38.35 90.77 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.608 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.37 -35.58 65.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.098 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.939 HG11 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.54 -17.89 9.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 114.732 -1.122 . . . . 0.0 111.706 -179.538 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.78 15.98 18.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.416 ' N ' ' O ' ' B' ' 83' ' ' LEU . 45.3 t -162.74 -42.41 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.852 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.404 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.6 OUTLIER -99.12 78.86 2.28 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.923 0.392 . . . . 0.0 111.869 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' B' ' 90' ' ' SER . 6.0 mp0 53.37 -163.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.415 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.411 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 3.2 m 81.72 -69.64 0.08 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.241 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.51 -37.52 4.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.103 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m -65.34 -27.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.364 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.41 -28.95 15.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.006 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.98 -30.13 70.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.059 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.757 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -154.86 66.8 5.14 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.038 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.452 ' N ' ' HD2' ' B' ' 97' ' ' PRO . 50.2 Cg_exo -57.5 -47.12 23.17 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.763 2.309 . . . . 0.0 112.622 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 98.2 Cg_endo -80.01 -25.3 5.16 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.336 2.024 . . . . 0.0 112.324 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.757 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.6 OUTLIER -67.78 85.04 0.21 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.64 168.15 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.835 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.75 -62.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.929 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.487 1.425 0 CA-C-O 120.765 0.317 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.423 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 1.3 mtp180 -89.96 -51.66 0.34 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.032 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 24.9 Cg_exo -67.82 -131.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.949 2.433 . . . . 0.0 111.846 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -172.6 147.01 1.77 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.328 0.585 . . . . 0.0 111.049 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.76 -46.44 10.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.114 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.999 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.19 -41.76 96.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.18 0.514 . . . . 0.0 109.932 179.057 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.5 mt-10 -51.66 -34.71 39.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.37 -35.43 40.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.842 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HB2' HD22 ' B' ' 13' ' ' LEU . 3.4 p -65.45 -40.7 93.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.066 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.039 HG22 HD11 ' A' ' 14' ' ' ILE . 2.6 mp -69.89 -56.17 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.402 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.1 -27.47 14.18 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.604 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.636 ' O ' HG13 ' A' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.887 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.953 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -59.75 -29.67 68.33 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.118 0.485 . . . . 0.0 112.086 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.039 HD11 HG22 ' A' ' 10' ' ' ILE . 8.0 mt -70.66 -39.04 75.37 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 CA-C-O 121.541 0.686 . . . . 0.0 110.539 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.5 -32.79 58.53 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.293 -176.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.953 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.0 m -52.09 -39.09 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.497 ' N ' HG23 ' A' ' 16' ' ' VAL . 9.1 t80 -77.85 -58.47 3.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.917 179.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.6 mm-40 -48.84 -30.97 6.39 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -51.56 68.95 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.804 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.763 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.05 -49.38 10.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.794 0.807 . . . . 0.0 109.962 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -57.25 -52.12 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.782 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -168.22 2.61 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.53 104.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.787 0.327 . . . . 0.0 110.885 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 60.68 156.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.17 155.59 31.82 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.474 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -99.83 163.06 12.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.835 0.35 . . . . 0.0 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m 62.43 151.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.9 m -84.74 60.87 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.064 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 31.7 p -123.57 -178.33 3.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.262 0.553 . . . . 0.0 111.031 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -131.73 -139.86 0.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.787 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.516 ' H ' HD22 ' A' ' 30' ' ' LEU . 1.3 p -164.33 136.72 4.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 3.4 pttt -49.72 -35.76 23.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.925 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.951 ' HA ' HD23 ' A' ' 36' ' ' LEU . 12.9 m -74.28 -53.18 10.26 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.856 -0.338 . . . . 0.0 111.779 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.462 ' HB3' ' CD1' ' A' ' 20' ' ' TYR . 25.4 mt-10 -55.63 -28.2 53.96 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.54 ' CE2' ' CD2' ' A' ' 76' ' ' PHE . 1.3 t80 -78.18 -43.02 29.73 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.209 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.951 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -68.23 -21.02 64.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.48 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -80.99 -26.55 36.42 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.141 0.496 . . . . 0.0 109.831 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.464 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 45.8 t80 -69.5 -24.48 63.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.666 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.593 ' CG ' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -72.44 -41.68 65.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.615 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -73.99 -19.4 60.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.4 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.4 p -106.32 -76.53 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 38' ' ' PHE . 2.0 mm-40 -68.41 -33.15 73.71 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.778 HD22 ' CD2' ' A' ' 46' ' ' PHE . 15.5 mt -121.95 43.73 2.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.074 0.464 . . . . 0.0 110.686 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -74.68 -25.02 58.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.809 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.08 -23.23 67.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.812 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.778 ' CD2' HD22 ' A' ' 43' ' ' LEU . 16.2 m-85 -95.55 -27.89 15.13 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.915 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.593 HG21 ' CG ' ' A' ' 39' ' ' MET . 11.7 t -125.26 42.59 3.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.839 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.06 -71.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.974 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -89.09 9.81 24.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.455 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 57.22 38.37 28.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.88 0.371 . . . . 0.0 110.997 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -37.67 67.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.944 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.589 ' HB3' HG23 ' A' ' 55' ' ' VAL . 0.9 OUTLIER -131.75 101.91 15.28 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.754 179.861 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -70.34 -0.87 8.03 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.798 2.332 . . . . 0.0 112.943 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -100.38 2.03 56.12 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.707 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 86' ' ' ALA . 23.6 t -84.76 -61.86 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.066 0.46 . . . . 0.0 111.437 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.546 HD13 ' CG ' ' A' ' 39' ' ' MET . 7.8 tp -75.1 -51.23 13.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.735 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.65 -33.76 64.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.489 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.571 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -64.27 -40.31 95.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.694 -179.626 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.883 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -61.69 -54.21 45.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.041 0.448 . . . . 0.0 111.199 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.892 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.75 -29.54 67.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.431 -179.119 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -78.12 -57.7 3.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.494 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -80.54 6.12 13.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.695 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.892 HD22 ' O ' ' A' ' 60' ' ' MET . 1.8 pt? -44.82 -31.56 1.27 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.062 0.458 . . . . 0.0 111.397 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.565 ' H ' HD23 ' A' ' 63' ' ' LEU . 6.6 t70 40.92 88.63 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.185 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.872 HD21 HD12 ' A' ' 63' ' ' LEU . 2.6 pp -164.27 123.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.936 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.85 24.2 2.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.43 153.27 34.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.662 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.16 -61.07 0.49 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.724 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.27 17.94 4.72 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.769 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.402 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 7.3 mm100 -150.81 -176.35 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 111.119 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.716 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.72 -142.5 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.403 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.491 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 171.74 -178.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.23 0.538 . . . . 0.0 111.731 179.121 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.5 p90 -61.77 -58.15 9.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.639 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.521 ' NE2' ' HB2' ' A' ' 77' ' ' LEU . 7.1 tp-100 -74.74 -25.38 59.07 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.608 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.789 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.95 -37.57 4.07 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.54 ' CD2' ' CE2' ' A' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.47 5.73 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.833 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.675 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.5 mt -53.98 -33.89 58.26 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.428 ' HB3' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -76.79 -50.05 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.242 177.874 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.789 HD13 ' O ' ' A' ' 75' ' ' GLU . 5.0 mp -58.05 -57.52 12.47 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.016 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HG12 ' B' ' 10' ' ' ILE . 0.1 OUTLIER -71.1 -46.03 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.027 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.668 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.91 -50.13 51.96 Favored Glycine 0 C--N 1.333 0.412 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.65 -35.12 37.17 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.687 178.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.883 HD21 ' CE ' ' A' ' 59' ' ' MET . 12.6 mt -61.74 -45.99 91.57 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.965 0.412 . . . . 0.0 109.979 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.48 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.37 -31.81 62.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.873 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.902 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.41 9.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.649 -179.598 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.761 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.73 13.01 17.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.341 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.77 -39.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.578 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.39 67.15 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.697 0.284 . . . . 0.0 111.737 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.7 -168.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m 76.09 5.51 3.75 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.652 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.503 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER 170.35 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 179.674 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.17 -27.7 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.165 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.8 ttpt -60.66 -66.64 0.5 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.889 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.17 -61.88 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.069 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.636 ' HB1' ' HB3' ' A' ' 98' ' ' GLN . . . 54.52 51.16 7.4 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.657 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.565 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 38.2 Cg_exo -57.64 -49.96 11.92 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.984 1.789 . . . . 0.0 111.503 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.557 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 82.5 Cg_endo -87.51 -51.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.478 2.119 . . . . 0.0 111.703 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.636 ' HB3' ' HB1' ' A' ' 95' ' ' ALA . 7.0 pt20 40.11 92.32 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.829 179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.68 115.66 30.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -93.08 -63.39 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.928 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.818 0.342 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.428 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 1.3 mtp180 -89.89 -51.61 0.34 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.976 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.428 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 25.0 Cg_exo -67.78 -131.35 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.073 2.516 . . . . 0.0 111.86 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.682 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -172.65 146.96 1.74 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.317 0.58 . . . . 0.0 111.142 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.69 -46.48 10.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.094 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.99 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.16 -41.82 97.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.894 179.048 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.682 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.5 mt-10 -51.65 -34.71 39.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.936 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.41 -35.38 40.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.757 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.616 ' HB2' HD22 ' A' ' 13' ' ' LEU . 3.4 p -65.62 -40.59 92.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.07 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.6 mp -69.85 -56.2 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.412 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.959 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.14 -27.43 14.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.878 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.932 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -59.84 -29.56 68.36 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.12 0.486 . . . . 0.0 112.085 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.0 mt -70.73 -38.96 74.99 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 121.478 0.656 . . . . 0.0 110.526 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.8 58.43 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.387 -1.279 . . . . 0.0 112.311 -176.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.932 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.2 m -52.15 -39.05 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 177.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.496 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 9.0 t80 -77.9 -58.52 3.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.839 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.809 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.7 mm-40 -48.91 -30.84 6.36 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -51.65 68.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.702 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.753 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.94 -49.39 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.869 0.842 . . . . 0.0 109.995 178.459 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -57.28 -52.08 66.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.23 -1.35 . . . . 0.0 111.859 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.12 -168.31 2.66 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.6 104.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.951 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 60.83 156.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.94 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.22 155.55 31.8 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.442 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -99.75 163.12 12.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m 62.38 151.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' B' ' 28' ' ' VAL . 26.8 m -84.8 60.9 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.9 p -123.65 -178.36 4.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.248 0.546 . . . . 0.0 111.025 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.753 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -131.63 -139.83 0.21 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.877 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.496 ' H ' HD22 ' B' ' 30' ' ' LEU . 1.3 p -164.43 136.63 4.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -49.59 -35.67 21.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.991 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.959 ' HA ' HD23 ' B' ' 36' ' ' LEU . 12.5 m -74.46 -53.06 10.28 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.755 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' ' CD1' ' B' ' 20' ' ' TYR . 25.4 mt-10 -55.68 -28.17 54.14 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.547 ' CE2' ' CD2' ' B' ' 76' ' ' PHE . 1.3 t80 -78.27 -42.95 29.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.183 178.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.959 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -68.3 -20.98 64.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.474 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -81.03 -26.54 36.31 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.133 0.492 . . . . 0.0 109.832 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB2' ' CE2' ' B' ' 20' ' ' TYR . 45.9 t80 -69.46 -24.54 63.81 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.588 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.6 ' CG ' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -72.39 -41.65 66.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.611 -179.595 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 0.1 OUTLIER -74.08 -19.34 60.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.349 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 28.5 p -106.32 -76.68 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.454 ' CB ' ' CZ ' ' B' ' 38' ' ' PHE . 2.0 mm-40 -68.33 -33.06 73.61 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.77 HD22 ' CD2' ' B' ' 46' ' ' PHE . 15.3 mt -122.16 43.93 2.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.134 0.492 . . . . 0.0 110.589 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.566 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -74.69 -25.03 58.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.88 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.05 -23.24 67.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.784 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.77 ' CD2' HD22 ' B' ' 43' ' ' LEU . 16.2 m-85 -95.59 -27.94 15.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.934 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.6 HG21 ' CG ' ' B' ' 39' ' ' MET . 11.7 t -125.23 42.64 3.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.918 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.13 -71.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -89.15 9.89 23.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.382 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 57.13 38.54 29.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.908 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -37.8 67.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' B' ' 55' ' ' VAL . 0.9 OUTLIER -131.72 101.92 15.32 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.744 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -70.33 -0.84 7.99 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.88 2.387 . . . . 0.0 112.99 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.568 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -100.37 2.02 56.13 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.788 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.773 HG22 ' O ' ' B' ' 86' ' ' ALA . 23.7 t -84.74 -61.9 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.078 0.466 . . . . 0.0 111.426 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.544 HD13 ' CG ' ' B' ' 39' ' ' MET . 7.7 tp -75.06 -51.24 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.723 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.62 -33.76 64.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.508 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -64.26 -40.3 95.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.642 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -61.78 -54.24 45.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.176 -179.4 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.875 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -68.59 -29.62 68.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.48 -179.219 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -78.11 -57.79 3.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' B' ' 62' ' ' LYS . 9.5 mptt -80.49 6.11 13.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.738 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.875 HD22 ' O ' ' B' ' 60' ' ' MET . 1.8 pt? -44.82 -31.52 1.25 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.02 0.438 . . . . 0.0 111.407 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.559 ' H ' HD23 ' B' ' 63' ' ' LEU . 6.6 t70 40.86 88.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.165 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.873 HD21 HD12 ' B' ' 63' ' ' LEU . 2.6 pp -164.25 123.13 1.89 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.99 24.25 2.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.907 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.45 153.27 34.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.17 -61.02 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.683 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 17.89 4.77 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.743 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -150.71 -176.21 5.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.775 0.321 . . . . 0.0 111.233 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.718 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -65.86 -142.44 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.417 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.485 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 171.75 -178.29 0.06 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.197 0.523 . . . . 0.0 111.799 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.902 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.0 p90 -61.77 -58.22 8.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.648 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.516 ' NE2' ' HB2' ' B' ' 77' ' ' LEU . 7.2 tp-100 -74.67 -25.37 59.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.623 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.87 -37.63 4.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.192 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.547 ' CD2' ' CE2' ' B' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.33 5.86 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.866 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.668 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.4 mt -54.15 -33.81 58.86 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.426 ' HB3' ' O ' ' B' ' 74' ' ' GLN . 0.0 OUTLIER -76.85 -50.02 14.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.233 177.884 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.795 HD13 ' O ' ' B' ' 75' ' ' GLU . 5.0 mp -58.01 -57.65 11.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.955 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.754 HD11 HG12 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -70.94 -46.13 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.071 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.675 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.89 -50.22 51.43 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.15 36.5 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.68 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 12.7 mt -61.66 -45.98 91.7 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 121.032 0.444 . . . . 0.0 110.009 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.506 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.39 -31.7 62.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.007 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.38 -17.52 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.61 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.773 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.63 12.96 17.34 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.361 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.474 ' HG ' ' HD1' ' B' ' 46' ' ' PHE . 0.5 OUTLIER -157.79 -39.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.625 -179.63 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.29 67.07 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.75 -168.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.363 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 7.8 m 76.1 5.4 3.75 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.622 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.502 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.2 OUTLIER 170.36 -52.04 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.78 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p -59.3 -27.66 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.126 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -60.65 -66.69 0.49 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.08 -61.94 1.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.622 ' HB1' ' HB3' ' B' ' 98' ' ' GLN . . . 54.57 51.11 7.29 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.636 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.568 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 38.5 Cg_exo -57.61 -49.87 12.21 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.994 1.796 . . . . 0.0 111.588 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.562 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 80.4 Cg_endo -87.59 -51.72 0.03 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 122.567 2.178 . . . . 0.0 111.687 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.622 ' HB3' ' HB1' ' B' ' 95' ' ' ALA . 6.9 pt20 40.23 92.22 0.01 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.782 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.55 115.57 30.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.863 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -93.04 -63.49 1.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.807 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.865 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 p . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.852 0.358 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 3' ' ' PRO . 0.5 OUTLIER -169.63 -64.11 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.948 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 2' ' ' ARG . 71.7 Cg_endo -66.06 -99.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.723 2.282 . . . . 0.0 112.33 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.688 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -162.19 145.96 12.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.374 0.607 . . . . 0.0 111.059 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.81 -47.76 10.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.034 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.905 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -63.42 -39.18 93.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.218 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.688 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.6 OUTLIER -52.28 -34.28 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.39 -39.68 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.01 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.8 p -58.6 -42.47 88.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.431 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.041 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -67.5 -56.05 14.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.906 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.88 -27.34 12.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.538 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.5 m -71.58 -55.84 7.0 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.946 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -63.55 -28.42 69.93 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.041 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -70.64 -37.01 67.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.574 0.702 . . . . 0.0 110.645 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.47 -33.08 58.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.278 -176.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.946 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.5 m -53.19 -38.95 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 177.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.572 ' CD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -75.25 -57.7 3.73 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.535 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.1 mm100 -48.87 -30.39 5.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -52.12 66.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.501 -0.479 . . . . 0.0 111.147 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.882 ' HB3' HD21 ' A' ' 30' ' ' LEU . 17.4 m-85 -81.17 -47.81 12.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.98 -25.05 57.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.645 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 158.59 31.39 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.349 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.4 92.93 1.18 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.349 . . . . 0.0 110.955 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.67 -49.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.87 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.76 -50.49 0.95 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.506 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -156.53 -67.03 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 110.986 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.0 t 59.1 79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.803 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.28 -17.56 7.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.574 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 16.6 p -139.32 178.73 6.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.127 0.489 . . . . 0.0 111.148 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.882 HD21 ' HB3' ' A' ' 20' ' ' TYR . 1.3 tt -125.27 -115.28 0.29 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.968 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.506 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 43.2 t 176.01 129.14 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.67 -35.7 22.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.717 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.2 -44.15 54.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -58.48 -28.84 65.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 0.0 110.1 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -70.49 -27.95 64.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.917 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.717 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.46 -58.98 5.72 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.677 0.751 . . . . 0.0 111.121 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.951 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 m -56.17 -44.09 79.02 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.46 -178.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' B' ' 6' ' ' THR . 10.2 t80 -57.57 -29.08 64.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.812 0.339 . . . . 0.0 110.748 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -76.52 -41.28 47.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.099 0.476 . . . . 0.0 110.759 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -73.67 -19.46 60.82 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.244 -179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 37' ' ' SER . 0.7 OUTLIER -98.18 -66.93 0.87 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.597 ' H ' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -96.29 -20.98 18.12 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -176.172 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.585 HD21 HD11 ' B' ' 10' ' ' ILE . 31.3 mt -120.61 45.89 2.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.203 0.525 . . . . 0.0 110.59 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -32.08 35.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.077 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.47 -23.65 51.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.839 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -90.42 -8.48 50.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.112 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.436 ' CG2' ' HG2' ' A' ' 39' ' ' MET . 6.7 p -112.84 -28.37 7.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.008 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -53.7 -79.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.926 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.406 ' O ' ' N ' ' A' ' 51' ' ' LYS . 14.1 m-20 -59.26 -55.54 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.323 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 59.7 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.431 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 49' ' ' ASN . 4.1 ttmt 59.69 25.57 14.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.931 0.395 . . . . 0.0 110.493 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -170.74 106.41 0.41 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.494 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.23 36.74 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.547 2.164 . . . . 0.0 112.801 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -137.29 5.03 3.51 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.95 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.66 -63.21 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.782 0.325 . . . . 0.0 111.431 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.2 OUTLIER -64.37 -50.37 67.98 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.89 -45.13 78.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.6 -25.33 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.891 0.377 . . . . 0.0 110.967 -179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . 1.032 ' HG3' HD21 ' A' ' 83' ' ' LEU . 9.5 mmm -65.62 -54.6 25.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.489 0.662 . . . . 0.0 112.006 -179.034 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.798 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -73.7 -48.69 30.17 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.722 -1.127 . . . . 0.0 112.409 -178.759 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HG3' ' N ' ' A' ' 62' ' ' LYS . 16.9 pttt -66.78 -52.71 40.82 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.687 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.433 ' N ' ' HG3' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -81.1 6.03 14.93 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.383 179.212 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.805 HD23 ' N ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -47.28 -27.76 1.68 Allowed 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.386 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.805 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.9 OUTLIER 34.18 83.67 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.292 179.62 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 65' ' ' LEU . 4.1 pp -134.57 152.4 51.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.89 0.376 . . . . 0.0 111.14 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -145.25 89.62 1.96 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.42 -50.07 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.724 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.77 36.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.697 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 69.84 13.78 69.58 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.679 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 10.8 mm-40 -119.52 -174.46 2.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 111.15 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.4 OUTLIER -69.56 -140.7 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.542 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.6 OUTLIER 173.45 169.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 0.0 111.062 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HB2' HG11 ' B' ' 85' ' ' VAL . 2.8 m-85 -59.13 -62.33 1.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.91 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.459 ' O ' ' N ' ' A' ' 78' ' ' ASN . 8.1 tp-100 -67.84 -28.86 67.91 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.65 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.638 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.51 -40.53 5.69 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 110.28 179.7 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' CG2' ' A' ' 16' ' ' VAL . 1.7 t80 -72.05 -53.99 11.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.277 178.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.501 HD21 ' CB ' ' A' ' 13' ' ' LEU . 5.7 mt -54.75 -33.81 61.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.459 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.4 m-20 -74.41 -49.85 20.9 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.38 178.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.891 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 7.3 mp -65.03 -58.29 6.46 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.721 -179.694 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.568 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -65.91 -46.68 87.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 O-C-N 123.351 0.407 . . . . 0.0 111.259 179.481 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.486 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -55.72 -50.43 60.83 Favored Glycine 0 CA--C 1.506 -0.488 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.61 -29.89 54.96 Favored Glycine 0 CA--C 1.523 0.54 0 C-N-CA 120.411 -0.9 . . . . 0.0 111.663 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 1.032 HD21 ' HG3' ' A' ' 59' ' ' MET . 24.6 mt -66.57 -47.32 73.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.075 0.464 . . . . 0.0 110.198 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.21 -34.71 64.16 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.801 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.498 HG11 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.08 -17.56 9.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.31 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.06 16.61 16.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.358 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' A' ' 83' ' ' LEU . 22.6 t -163.55 -30.85 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.587 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 57.2 t60 -84.5 51.73 2.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.817 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.64 32.6 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -94.17 -67.03 0.88 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.486 179.623 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.19 -35.96 7.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.337 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.451 HG21 ' HA ' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -57.19 -33.21 42.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.878 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -15.98 64.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.932 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.434 ' C ' ' HD3' ' A' ' 96' ' ' PRO . . . -136.34 58.93 1.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.807 0.336 . . . . 0.0 111.263 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.902 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -126.98 64.99 62.28 Favored Pre-proline 0 CA--C 1.531 0.23 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.302 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.449 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 41.1 Cg_exo -58.81 -47.36 18.68 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.651 2.234 . . . . 0.0 112.918 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.449 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 98.4 Cg_endo -79.88 -3.64 12.9 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.307 2.005 . . . . 0.0 112.655 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.902 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -90.79 11.03 23.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.283 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 54.05 177.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.829 0.347 . . . . 0.0 110.978 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.428 ' HG3' ' CD2' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -107.51 -30.74 8.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.428 ' CD2' ' HG3' ' A' ' 100' ' ' ARG . 13.2 p90 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.929 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.778 0.323 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.451 ' CB ' ' CD ' ' B' ' 3' ' ' PRO . 0.5 OUTLIER -169.56 -64.1 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' B' ' 2' ' ' ARG . 70.5 Cg_endo -66.08 -99.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.758 2.306 . . . . 0.0 112.278 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.689 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -162.1 146.0 12.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 111.018 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.84 -47.73 11.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.027 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.908 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.9 OUTLIER -63.44 -39.13 93.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.247 179.221 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.689 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.6 OUTLIER -52.39 -34.24 47.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.705 179.867 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.42 -39.58 32.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.987 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.8 p -58.64 -42.51 88.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.372 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -67.57 -56.05 14.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.819 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.979 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.9 -27.23 12.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.564 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.5 m -71.75 -55.67 7.2 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.942 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -63.68 -28.36 69.84 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.105 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -70.73 -36.96 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.562 0.696 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.54 -33.08 58.57 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.233 -176.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.942 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.7 m -53.23 -38.86 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.58 ' CD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -75.24 -57.75 3.71 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.58 179.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.1 mm100 -48.96 -30.38 5.91 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -52.29 65.96 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.101 -178.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.852 ' HB3' HD21 ' B' ' 30' ' ' LEU . 17.4 m-85 -81.04 -47.89 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.767 0.794 . . . . 0.0 109.873 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.87 -25.08 55.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.632 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.86 158.57 31.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.389 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.43 92.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.349 . . . . 0.0 110.932 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.74 -49.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.793 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.78 -50.34 0.96 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.557 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -156.61 -66.98 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.812 0.339 . . . . 0.0 110.948 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t 59.06 79.14 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.33 -17.54 7.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.579 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.412 HG22 ' O ' ' B' ' 71' ' ' LEU . 16.6 p -139.3 178.77 6.95 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.141 0.496 . . . . 0.0 111.166 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.852 HD21 ' HB3' ' B' ' 20' ' ' TYR . 1.3 tt -125.29 -115.34 0.28 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.951 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.51 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 43.4 t 176.01 129.16 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.444 ' HB3' ' HE2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.7 -35.79 23.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.914 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.733 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.07 -44.2 54.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.886 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.7 OUTLIER -58.57 -28.78 65.86 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.094 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -70.38 -28.09 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.964 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.733 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.51 -58.89 6.07 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.714 0.769 . . . . 0.0 111.057 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.968 ' O ' HG22 ' B' ' 41' ' ' THR . 3.2 m -56.13 -44.18 78.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.421 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.438 ' HE1' HG21 ' A' ' 6' ' ' THR . 10.2 t80 -57.47 -29.14 64.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.899 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -76.5 -41.34 47.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.692 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -73.61 -19.49 60.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.221 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.968 HG22 ' O ' ' B' ' 37' ' ' SER . 0.6 OUTLIER -98.22 -66.93 0.87 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -177.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.6 ' H ' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -96.23 -20.92 18.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 -176.292 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.588 HD21 HD11 ' A' ' 10' ' ' ILE . 31.6 mt -120.57 45.78 2.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.618 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.75 -32.14 35.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.998 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.51 -23.67 51.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.754 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -90.35 -8.52 50.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.18 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.43 ' CG2' ' HG2' ' B' ' 39' ' ' MET . 6.6 p -112.79 -28.4 7.78 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.024 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 mttt -53.79 -79.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.907 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ASN . . . . . 0.412 ' O ' ' N ' ' B' ' 51' ' ' LYS . 14.1 m-20 -59.23 -55.53 33.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.865 0.364 . . . . 0.0 110.351 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.66 -80.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.526 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' B' ' 49' ' ' ASN . 4.1 ttmt 59.74 25.51 14.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 110.49 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -170.63 106.46 0.42 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.564 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.28 36.72 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.545 2.163 . . . . 0.0 112.791 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.498 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -137.22 4.97 3.52 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.906 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -84.66 -63.2 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.946 0.373 . . . . 0.0 111.422 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' ' HG2' ' B' ' 59' ' ' MET . 0.2 OUTLIER -64.46 -50.28 68.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.84 -45.2 78.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -58.62 -25.23 62.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.95 0.405 . . . . 0.0 111.024 -179.784 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 59' ' ' MET . . . . . 1.069 ' HG3' HD21 ' B' ' 83' ' ' LEU . 9.5 mmm -65.65 -54.62 25.13 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.497 0.665 . . . . 0.0 112.021 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.792 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -73.73 -48.64 30.39 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.436 -178.716 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' B' ' 62' ' ' LYS . 16.8 pttt -66.64 -52.82 40.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.762 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' LYS . . . . . 0.429 ' N ' ' HG3' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -81.06 5.98 14.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.446 179.188 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.812 HD23 ' N ' ' B' ' 64' ' ' ASP . 0.7 OUTLIER -47.23 -27.73 1.63 Allowed 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.376 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.812 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.9 OUTLIER 34.14 83.67 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.313 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.542 ' O ' HD12 ' B' ' 65' ' ' LEU . 4.0 pp -134.57 152.4 51.76 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.934 0.397 . . . . 0.0 111.045 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -145.26 89.6 1.96 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.37 -49.98 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.766 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.9 36.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.68 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 69.79 13.74 69.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.631 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 10.8 mm-40 -119.43 -174.42 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.933 0.397 . . . . 0.0 111.122 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.585 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.4 OUTLIER -69.66 -140.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.6 OUTLIER 173.36 169.86 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.933 0.396 . . . . 0.0 111.044 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.498 ' HB2' HG11 ' A' ' 85' ' ' VAL . 2.8 m-85 -59.16 -62.32 1.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.86 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' B' ' 78' ' ' ASN . 8.1 tp-100 -67.97 -28.75 67.72 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.625 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.623 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.54 -40.52 5.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 110.201 179.688 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.462 ' CE1' ' CG2' ' B' ' 16' ' ' VAL . 1.7 t80 -72.05 -54.04 11.05 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.294 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.506 HD21 ' CB ' ' B' ' 13' ' ' LEU . 5.7 mt -54.68 -33.84 61.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.402 0.62 . . . . 0.0 109.516 178.157 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.4 m-20 -74.44 -49.85 20.78 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.33 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.906 ' HG ' ' HB3' ' B' ' 59' ' ' MET . 7.2 mp -65.01 -58.31 6.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.732 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.564 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -65.97 -46.55 87.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 O-C-N 123.386 0.429 . . . . 0.0 111.283 179.524 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.496 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -55.72 -50.47 60.61 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.45 -30.03 54.68 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.467 -0.873 . . . . 0.0 111.69 177.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 1.069 HD21 ' HG3' ' B' ' 59' ' ' MET . 24.7 mt -66.69 -47.22 73.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.043 0.449 . . . . 0.0 110.177 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.572 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.24 -34.81 64.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.689 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.509 HG11 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.03 -17.48 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.364 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.09 16.56 16.0 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.244 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' B' ' 83' ' ' LEU . 22.8 t -163.53 -30.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.572 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 57.1 t60 -84.48 51.72 2.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.831 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.62 32.57 0.06 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 0.4 OUTLIER -94.09 -67.04 0.88 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 110.486 179.645 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.15 -36.05 7.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.389 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.442 HG21 ' CA ' ' B' ' 87' ' ' CYS . 0.0 OUTLIER -57.04 -33.25 42.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.957 179.698 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -15.99 64.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.915 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 94' ' ' ALA . . . . . 0.429 ' C ' ' HD3' ' B' ' 96' ' ' PRO . . . -136.36 58.86 1.72 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.312 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.89 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -126.91 64.9 61.38 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.443 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 40.6 Cg_exo -58.65 -47.45 18.77 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.706 2.271 . . . . 0.0 112.95 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 99.0 Cg_endo -79.86 -3.67 12.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.345 2.03 . . . . 0.0 112.54 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.89 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.0 OUTLIER -90.84 11.03 23.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.221 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp 53.99 177.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.058 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 100' ' ' ARG . . . . . 0.426 ' HG3' ' CD2' ' B' ' 101' ' ' PHE . 0.0 OUTLIER -107.52 -30.77 8.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 101' ' ' PHE . . . . . 0.426 ' CD2' ' HG3' ' B' ' 100' ' ' ARG . 12.9 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.868 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.798 0.333 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.427 ' N ' ' HD3' ' A' ' 3' ' ' PRO . 9.0 mmp_? 59.07 64.4 3.22 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.997 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.44 ' HB2' ' CB ' ' A' ' 7' ' ' GLU . 34.7 Cg_exo -64.37 -126.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.022 2.482 . . . . 0.0 111.986 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.565 HG23 ' H ' ' A' ' 7' ' ' GLU . 10.1 t -95.45 156.72 16.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.67 0.748 . . . . 0.0 111.263 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.9 -48.04 11.24 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.868 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.824 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.9 m -67.11 -34.42 77.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.736 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.565 ' H ' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.91 -45.98 64.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.882 0.373 . . . . 0.0 110.579 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -26.81 66.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.401 178.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.449 ' CB ' ' HB3' ' B' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.678 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.022 HG12 HD11 ' B' ' 80' ' ' ILE . 1.6 mp -48.9 -56.11 2.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.877 0.37 . . . . 0.0 111.652 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.958 ' HA ' HD12 ' A' ' 14' ' ' ILE . 5.2 mt-10 -51.85 -27.19 11.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.722 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.4 m -62.09 -55.9 24.26 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.011 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -76.04 -27.83 57.46 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.018 HD11 HG22 ' A' ' 10' ' ' ILE . 7.2 mt -67.15 -37.3 78.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.489 0.662 . . . . 0.0 111.008 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.92 -32.59 57.48 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.565 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.011 HG22 ' O ' ' A' ' 13' ' ' LEU . 22.1 m -52.02 -38.2 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.482 ' N ' HG23 ' A' ' 16' ' ' VAL . 7.6 t80 -77.4 -58.42 3.29 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.244 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.805 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.3 mm100 -49.12 -25.61 2.25 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.3 -52.74 36.84 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.916 -178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.908 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.1 m-85 -81.6 -39.47 24.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.828 0.823 . . . . 0.0 109.894 178.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.558 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -70.6 -27.82 64.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.853 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -125.66 123.58 4.95 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.567 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.73 29.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.749 0.309 . . . . 0.0 110.848 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -166.16 31.75 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.917 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.89 -61.17 1.66 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.501 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -79.2 154.59 29.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 82.2 p -162.31 115.26 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.798 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.422 HG13 ' N ' ' A' ' 29' ' ' THR . 12.2 p -134.43 -41.76 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.48 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HA ' ' A' ' 72' ' ' ASP . 2.5 p -134.93 154.76 51.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.908 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -111.05 -136.39 0.37 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.918 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.476 ' H ' HD22 ' A' ' 30' ' ' LEU . 6.5 t -168.01 133.84 1.94 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.771 0.32 . . . . 0.0 110.539 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' CB ' HD11 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -49.86 -39.97 40.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.739 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -69.17 -46.63 67.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.424 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.74 65.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.033 0.444 . . . . 0.0 110.287 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -69.31 -29.4 67.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.111 179.012 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.739 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -51.73 -59.06 4.73 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.636 0.731 . . . . 0.0 111.297 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -47.23 81.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.57 -1.195 . . . . 0.0 111.386 -178.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 42' ' ' GLU . 10.8 t80 -57.73 -51.07 71.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.673 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.439 ' HE3' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.551 179.76 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.75 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 89.3 m-20 -73.53 -19.84 60.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.881 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -118.97 -80.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.107 0.479 . . . . 0.0 111.501 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 38' ' ' PHE . 2.2 mm-40 -46.0 -38.58 7.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.027 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.84 HD21 HD11 ' B' ' 10' ' ' ILE . 23.3 mt -130.69 50.8 2.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.937 0.399 . . . . 0.0 110.679 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.75 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -80.78 -35.19 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.099 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.417 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . . . -56.98 -25.06 57.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.162 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.454 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 43.6 m-85 -91.97 15.09 13.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.423 HG21 ' CG ' ' A' ' 39' ' ' MET . 26.3 p -139.12 -42.65 0.46 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.492 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 45' ' ' ALA . 0.7 OUTLIER -59.91 94.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.973 179.956 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 58.75 85.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.66 134.82 53.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.851 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -27.03 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.566 ' HB3' HG23 ' A' ' 55' ' ' VAL . 2.3 m-20 -100.23 103.96 26.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -81.2 5.42 6.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.621 2.214 . . . . 0.0 112.874 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.74 -11.97 29.31 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.85 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.617 HG22 ' O ' ' A' ' 86' ' ' ALA . 40.8 t -52.92 -59.86 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.766 0.317 . . . . 0.0 111.404 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.826 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -67.81 -51.68 45.85 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.152 0.501 . . . . 0.0 110.488 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.826 ' N ' HD23 ' A' ' 56' ' ' LEU . 1.7 t0 -55.11 -26.83 40.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.905 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.588 HH21 ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -61.97 -47.26 85.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.682 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.842 ' CE ' HD21 ' A' ' 83' ' ' LEU . 5.1 ptp -69.31 -53.78 17.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.642 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.0 mtm -59.96 -26.27 65.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.898 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -61.11 -59.88 4.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.647 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -6.05 57.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.732 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.899 ' HB2' HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.26 6.01 15.4 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.627 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.08 84.89 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.849 0.357 . . . . 0.0 110.748 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.701 HD11 ' OE1' ' A' ' 75' ' ' GLU . 2.2 mm? -73.72 116.61 14.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.896 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.45 -43.0 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.775 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.93 161.15 13.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.981 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 76.3 -53.35 0.6 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.686 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.83 23.43 23.14 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.204 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.507 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 4.2 mm100 -155.95 167.79 29.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.699 0.285 . . . . 0.0 111.401 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.698 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -64.49 -132.79 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.663 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.509 ' HA ' HG22 ' A' ' 29' ' ' THR . 2.3 t0 176.71 -171.37 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.81 0.732 . . . . 0.0 111.444 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.801 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.4 p90 -77.6 -54.87 5.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.489 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.478 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -77.63 -30.36 52.19 Favored 'General case' 0 CA--C 1.515 -0.37 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.326 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.726 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -44.83 -33.1 1.8 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -80.44 -54.4 5.73 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.847 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' B' ' 77' ' ' LEU . 6.9 mt -55.98 -33.37 64.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.408 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.14 -39.68 54.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.135 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.899 HD11 ' HB2' ' A' ' 63' ' ' LEU . 1.7 mp -64.56 -57.77 8.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.748 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.038 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.82 -43.71 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.139 179.427 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.71 -50.31 49.93 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.005 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.49 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.71 -35.52 38.57 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.359 -0.924 . . . . 0.0 111.427 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.842 HD21 ' CE ' ' A' ' 59' ' ' MET . 8.4 mt -62.19 -46.07 90.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.921 0.391 . . . . 0.0 110.098 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.32 -35.42 65.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 110.849 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.812 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -81.09 -17.15 12.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.115 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HG13 ' A' ' 92' ' ' VAL . . . -117.35 15.72 14.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.552 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -160.99 -27.43 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -179.443 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.525 ' HB2' ' O ' ' A' ' 84' ' ' ALA . 14.2 m-70 -93.79 27.56 2.68 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.611 -0.436 . . . . 0.0 112.159 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.783 ' HA ' HG23 ' A' ' 92' ' ' VAL . 1.4 mp0 59.34 16.51 5.11 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -72.94 -50.7 21.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.949 0.404 . . . . 0.0 109.95 179.334 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -113.03 -38.75 4.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.779 178.775 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.783 HG23 ' HA ' ' A' ' 89' ' ' GLU . 1.6 m -58.59 -25.45 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.087 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -81.36 -2.39 49.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.365 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.73 64.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.78 0.324 . . . . 0.0 111.175 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.846 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -141.64 60.07 10.92 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.314 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 35.0 Cg_exo -59.41 -46.64 20.17 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.68 2.253 . . . . 0.0 112.985 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 86.4 Cg_endo -82.62 -17.78 7.16 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.511 2.14 . . . . 0.0 112.918 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.846 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 1.2 tt0 -50.14 109.59 0.31 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.904 0.383 . . . . 0.0 111.128 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -59.81 -176.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.43 75.0 1.38 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.955 -179.993 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.766 0.317 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.415 ' N ' ' HD3' ' B' ' 3' ' ' PRO . 9.1 mmp_? 59.05 64.37 3.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.994 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.444 ' HB2' ' CB ' ' B' ' 7' ' ' GLU . 35.1 Cg_exo -64.35 -126.85 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.024 2.483 . . . . 0.0 112.076 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.571 HG23 ' H ' ' B' ' 7' ' ' GLU . 10.1 t -95.55 156.75 16.19 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.625 0.726 . . . . 0.0 111.328 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.88 -48.14 11.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.801 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.801 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.8 m -67.06 -34.33 77.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.762 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.571 ' H ' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.99 -45.95 64.68 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.534 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -26.8 66.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.448 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.09 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.655 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.055 HG22 HD11 ' B' ' 14' ' ' ILE . 1.6 mp -48.94 -56.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.543 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 5.3 mt-10 -51.77 -27.27 11.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.7 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.3 m -62.07 -55.83 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 1.017 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -76.17 -27.75 57.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.055 HD11 HG22 ' B' ' 10' ' ' ILE . 7.1 mt -67.19 -37.27 78.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 O-C-N 121.558 -0.714 . . . . 0.0 110.964 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.99 -32.63 57.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.469 -1.241 . . . . 0.0 112.539 -176.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 1.017 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.0 m -52.05 -38.17 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' B' ' 16' ' ' VAL . 7.5 t80 -77.46 -58.38 3.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.155 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.4 mm100 -49.17 -25.65 2.33 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.13 -52.83 36.83 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.891 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.929 ' HB3' HD21 ' B' ' 30' ' ' LEU . 8.1 m-85 -81.63 -39.44 24.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.808 0.813 . . . . 0.0 109.864 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.569 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -70.64 -27.83 64.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.816 -179.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -125.61 123.51 4.93 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.629 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.68 29.19 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.862 0.363 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -166.12 31.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.8 -61.07 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.537 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -79.2 154.53 29.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.908 0.385 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 81.0 p -162.25 115.19 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.812 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.42 HG13 ' N ' ' B' ' 29' ' ' THR . 12.0 p -134.52 -41.7 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.472 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.525 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 2.4 p -135.05 154.85 51.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.535 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.929 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -111.02 -136.37 0.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.015 179.817 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.474 ' H ' HD22 ' B' ' 30' ' ' LEU . 6.5 t -167.98 133.82 1.95 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.756 0.312 . . . . 0.0 110.577 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.451 ' CB ' HD11 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -49.81 -39.97 40.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.96 -179.712 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -69.2 -46.65 66.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.58 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.419 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.76 65.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.953 0.406 . . . . 0.0 110.195 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.763 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -69.25 -29.51 67.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.069 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.61 -59.02 4.74 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.664 0.745 . . . . 0.0 111.371 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.42 -47.16 82.49 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.346 -178.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' B' ' 42' ' ' GLU . 10.9 t80 -57.76 -51.07 71.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.65 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.456 ' HE3' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -63.29 -30.93 71.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.547 179.699 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.735 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 89.3 m-20 -73.48 -19.8 60.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.843 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -119.02 -80.38 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 0.0 111.491 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.444 ' HB2' ' CE1' ' B' ' 38' ' ' PHE . 2.1 mm-40 -46.03 -38.56 8.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.031 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 10' ' ' ILE . 23.4 mt -130.77 50.81 2.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.982 0.42 . . . . 0.0 110.662 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -80.77 -35.21 33.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.068 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' B' ' 48' ' ' LYS . . . -57.05 -24.99 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.175 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 43.9 m-85 -91.87 14.96 14.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.133 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.419 HG21 ' CG ' ' B' ' 39' ' ' MET . 26.3 p -139.01 -42.77 0.47 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.95 0.405 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' B' ' 45' ' ' ALA . 0.7 OUTLIER -59.8 94.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.032 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.73 85.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.85 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.67 134.85 53.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.931 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -27.03 63.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.569 ' HB3' HG23 ' B' ' 55' ' ' VAL . 2.3 m-20 -100.24 103.96 26.54 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.896 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.19 5.46 6.23 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.547 2.164 . . . . 0.0 112.904 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.76 -11.88 29.47 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.909 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.623 HG22 ' O ' ' B' ' 86' ' ' ALA . 41.0 t -52.97 -59.89 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.741 0.305 . . . . 0.0 111.314 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.835 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.2 OUTLIER -67.77 -51.71 45.72 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.216 0.532 . . . . 0.0 110.536 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.835 ' N ' HD23 ' B' ' 56' ' ' LEU . 1.7 t0 -55.09 -26.87 40.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.881 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.59 HH21 ' HB2' ' B' ' 86' ' ' ALA . 0.2 OUTLIER -61.91 -47.19 86.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.708 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.854 ' CE ' HD21 ' B' ' 83' ' ' LEU . 5.1 ptp -69.44 -53.81 17.48 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.908 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.655 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.0 mtm -59.95 -26.3 65.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.776 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -61.1 -59.95 4.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.618 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.25 -5.94 57.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.903 ' HB2' HD11 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -81.34 6.01 15.63 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.15 84.94 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.926 0.393 . . . . 0.0 110.742 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.692 HD11 ' OE1' ' B' ' 75' ' ' GLU . 2.2 mm? -73.67 116.62 14.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.47 -42.88 3.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.821 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 161.23 13.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.907 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 76.2 -53.32 0.61 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.684 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.85 23.5 22.89 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.144 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.525 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 4.1 mm100 -156.03 167.77 29.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.762 0.315 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.702 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -64.48 -132.81 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.489 ' HA ' HG22 ' B' ' 29' ' ' THR . 2.3 t0 176.67 -171.37 0.08 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.798 0.727 . . . . 0.0 111.409 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.812 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.4 p90 -77.65 -54.96 5.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.433 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -77.57 -30.38 52.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.319 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.72 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.79 -33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.858 0.361 . . . . 0.0 110.155 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.595 ' HD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -80.32 -54.42 5.74 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.882 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' A' ' 77' ' ' LEU . 6.9 mt -55.95 -33.37 64.7 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.412 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.12 -39.8 54.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.101 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.903 HD11 ' HB2' ' B' ' 63' ' ' LEU . 1.7 mp -64.36 -57.92 7.97 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.773 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 1.022 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.75 -43.77 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.137 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.69 -50.27 49.97 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.316 -0.945 . . . . 0.0 111.068 179.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.8 -35.45 39.06 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.394 178.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.854 HD21 ' CE ' ' B' ' 59' ' ' MET . 8.6 mt -62.29 -46.06 90.48 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.896 0.379 . . . . 0.0 110.048 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.52 ' O ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.42 -35.3 65.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.329 0.585 . . . . 0.0 110.812 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.801 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -81.08 -17.25 12.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.159 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.683 ' HA ' HG13 ' B' ' 92' ' ' VAL . . . -117.31 15.72 14.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.534 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.411 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.3 OUTLIER -160.98 -27.37 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.52 ' HB2' ' O ' ' B' ' 84' ' ' ALA . 14.1 m-70 -93.92 27.67 2.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.547 -0.461 . . . . 0.0 112.121 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.763 ' HA ' HG23 ' B' ' 92' ' ' VAL . 1.4 mp0 59.31 16.52 5.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.431 ' CB ' ' HA ' ' B' ' 85' ' ' VAL . 0.2 OUTLIER -72.88 -50.75 21.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.971 0.415 . . . . 0.0 109.931 179.359 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.712 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -113.06 -38.69 4.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.789 178.841 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.763 HG23 ' HA ' ' B' ' 89' ' ' GLU . 1.6 m -58.61 -25.46 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.156 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -81.33 -2.44 49.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.348 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.73 64.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.801 0.334 . . . . 0.0 111.199 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.824 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -141.67 60.12 10.96 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.282 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.479 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 35.3 Cg_exo -59.5 -46.69 19.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.623 2.215 . . . . 0.0 112.904 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 86.8 Cg_endo -82.54 -17.77 7.26 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.478 2.119 . . . . 0.0 112.99 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.824 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 1.2 tt0 -50.09 109.56 0.31 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.865 0.364 . . . . 0.0 111.131 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -59.71 -176.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.02 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.53 75.07 1.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.851 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.862 179.958 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.856 0.36 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.4 OUTLIER -179.48 -51.4 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.058 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 17.2 Cg_exo -71.88 -134.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.15 2.567 . . . . 0.0 111.85 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.473 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -104.58 152.98 21.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 0.0 111.189 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.82 -49.06 10.97 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.421 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.939 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.25 -41.56 96.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.093 0.473 . . . . 0.0 110.194 179.207 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.473 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.0 OUTLIER -51.44 -31.61 23.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -28.31 41.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.928 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 4.3 p -73.95 -40.66 62.89 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.391 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 14' ' ' ILE . 2.5 mp -66.92 -56.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.902 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -52.18 -27.33 14.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.428 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.581 ' O ' HG13 ' A' ' 16' ' ' VAL . 5.9 m -72.19 -56.03 6.24 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -178.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.837 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -64.9 -27.5 68.9 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.077 HD11 HG22 ' A' ' 10' ' ' ILE . 12.8 mt -69.06 -37.35 76.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 CA-C-O 121.491 0.662 . . . . 0.0 110.611 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.465 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . . . -76.49 -39.69 52.41 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 114.027 -1.442 . . . . 0.0 112.402 -176.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 13' ' ' LEU . 20.2 m -50.96 -33.89 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 1.3 t80 -80.55 -59.01 2.85 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.222 -1.354 . . . . 0.0 113.249 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.67 -24.73 62.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -177.4 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -51.61 62.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.817 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.565 ' HB3' ' CE2' ' A' ' 38' ' ' PHE . 7.1 m-85 -80.83 -40.89 24.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.889 0.852 . . . . 0.0 109.564 177.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -62.58 -12.97 26.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.285 -179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -70.2 65.36 0.73 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.463 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -81.8 -51.81 7.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.92 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.73 174.65 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.86 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.69 -27.51 56.78 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.522 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -101.37 32.56 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 110.936 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -148.08 140.11 24.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.883 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.0 p -140.06 63.86 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.106 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.543 HG22 ' HA ' ' A' ' 72' ' ' ASP . 9.3 p -148.23 -179.38 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.692 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -138.97 -161.12 1.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.953 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.622 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -136.66 132.37 34.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.691 0.281 . . . . 0.0 110.398 178.781 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -40.64 41.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.512 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.713 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.17 -41.45 61.46 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.534 179.413 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 2.0 mt-10 -58.91 -32.36 69.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.079 0.466 . . . . 0.0 109.782 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.719 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -69.09 -26.88 65.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.385 179.295 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.713 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.61 -59.2 5.18 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.613 0.721 . . . . 0.0 111.191 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.452 ' O ' HG22 ' A' ' 41' ' ' THR . 14.6 m -60.16 -45.14 94.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.204 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.63 ' HE2' HD11 ' A' ' 30' ' ' LEU . 2.6 m-30 -57.8 -26.71 62.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.608 ' HG2' HG21 ' A' ' 47' ' ' THR . 2.7 ttm -78.24 -56.12 4.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.89 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -57.55 -19.69 27.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.025 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.959 HG23 ' HG2' ' A' ' 42' ' ' GLU . 10.8 t -96.68 -30.76 13.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.959 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -127.46 -37.5 2.0 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -177.551 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' B' ' 10' ' ' ILE . 7.9 mt -106.85 35.25 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.24 0.543 . . . . 0.0 110.256 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -77.11 -28.61 54.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.745 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.46 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . . . -54.15 -27.46 33.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.74 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CZ ' ' CD2' ' A' ' 88' ' ' HIS . 3.5 m-85 -86.46 -28.23 23.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.591 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.608 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.7 p -83.74 -33.36 25.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.212 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' A' ' 45' ' ' ALA . 1.6 pttt -72.91 -31.82 64.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.858 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -115.87 44.53 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.577 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -60.44 -61.2 2.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.271 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 59.54 25.59 14.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.42 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -174.6 118.65 0.34 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.565 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 3.0 Cg_exo -75.13 12.4 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.68 2.254 . . . . 0.0 113.062 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.23 7.55 23.05 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.845 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' ' 86' ' ' ALA . 53.3 t -84.08 -62.74 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.056 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 56' ' ' LEU . 6.6 tt -66.82 -51.96 49.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.664 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -26.85 47.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.036 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.9 -52.95 63.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.915 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.879 ' CE ' HD21 ' A' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.54 55.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.915 0.388 . . . . 0.0 111.002 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.847 ' HE3' HD21 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -54.71 -37.93 66.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.518 -179.343 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -78.03 -31.07 50.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.867 0.365 . . . . 0.0 110.622 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.33 -23.11 40.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.991 -179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.887 ' HB3' HD11 ' A' ' 79' ' ' LEU . 2.2 pp -81.37 7.14 12.36 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -59.6 68.34 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.018 0.437 . . . . 0.0 110.018 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -76.21 159.84 30.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.163 -179.144 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 -94.64 20.74 8.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.82 -31.75 15.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 0.0 110.639 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 49.89 28.01 2.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.94 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -123.43 -60.67 0.19 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.738 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.481 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 6.3 mm100 -151.34 -177.7 6.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.753 0.311 . . . . 0.0 111.423 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -64.6 -133.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.543 ' HA ' HG22 ' A' ' 29' ' ' THR . 1.7 t0 175.46 -169.51 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 118.801 0.728 . . . . 0.0 111.49 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.831 ' CD2' HG21 ' B' ' 85' ' ' VAL . 38.4 p90 -73.69 -58.86 3.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.469 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.482 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.05 -25.49 40.11 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.175 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.879 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -44.88 -32.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.378 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 t80 -80.12 -54.07 6.11 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.572 178.071 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' B' ' 77' ' ' LEU . 7.1 mt -56.97 -33.52 67.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.979 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.09 -42.01 57.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 63' ' ' LEU . 1.2 mp -65.92 -57.3 8.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.132 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.888 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.13 -44.5 64.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.948 179.316 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.73 -50.24 50.36 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.145 -1.026 . . . . 0.0 110.731 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.63 -40.1 47.28 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.362 -0.923 . . . . 0.0 111.551 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.879 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.9 mt -59.17 -46.36 88.6 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.892 0.377 . . . . 0.0 110.353 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.725 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.5 -33.65 63.92 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 111.291 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -82.65 -17.07 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.282 -179.476 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.828 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -116.78 11.86 14.65 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.878 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.433 ' N ' HG22 ' A' ' 92' ' ' VAL . 18.6 t -152.75 -39.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.0 OUTLIER -89.82 -85.27 0.21 Allowed 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.82 -179.178 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -133.15 177.19 7.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.734 0.302 . . . . 0.0 111.079 -179.395 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 70.7 m 60.9 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.631 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.449 ' CZ ' ' NE2' ' A' ' 98' ' ' GLN . 0.1 OUTLIER 76.25 -49.45 0.59 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.247 -179.743 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.433 HG22 ' N ' ' A' ' 87' ' ' CYS . 35.9 t -43.42 -53.6 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 121.078 0.466 . . . . 0.0 111.575 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.33 26.36 2.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.097 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -158.85 27.52 0.22 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.052 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.726 ' HB3' ' CD ' ' A' ' 96' ' ' PRO . . . -90.42 -68.97 0.1 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.388 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.726 ' CD ' ' HB3' ' A' ' 95' ' ' ALA . 5.8 Cg_endo -46.98 -35.84 19.27 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.762 2.308 . . . . 0.0 113.868 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.587 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 5.5 Cg_exo -74.91 -27.59 10.07 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.091 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.449 ' NE2' ' CZ ' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -57.66 -51.52 69.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.936 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.43 128.43 44.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -77.13 124.33 27.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.926 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.747 0.308 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.413 ' N ' ' CD ' ' B' ' 3' ' ' PRO . 0.4 OUTLIER -179.45 -51.46 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 17.2 Cg_exo -71.78 -134.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.451 0 C-N-CA 123.192 2.595 . . . . 0.0 111.924 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.461 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -104.55 153.05 21.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.572 0.701 . . . . 0.0 111.194 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.85 -49.06 11.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.415 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.934 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.22 -41.67 96.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 110.128 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.0 OUTLIER -51.47 -31.44 23.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.695 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -28.31 40.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.588 ' HB2' HD22 ' A' ' 13' ' ' LEU . 4.3 p -73.95 -40.64 62.91 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.421 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.137 HG22 HD11 ' B' ' 14' ' ' ILE . 2.5 mp -66.77 -56.31 14.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.895 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.4 OUTLIER -52.13 -27.34 13.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.571 ' O ' HG13 ' B' ' 16' ' ' VAL . 5.9 m -72.12 -56.11 6.15 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.83 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -64.75 -27.69 69.07 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.137 HD11 HG22 ' B' ' 10' ' ' ILE . 13.0 mt -68.99 -37.42 77.2 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.78 0 CA-C-O 121.539 0.685 . . . . 0.0 110.608 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' ALA . . . . . 0.465 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . . . -76.42 -39.66 52.92 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 113.962 -1.472 . . . . 0.0 112.442 -176.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.83 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.2 m -50.91 -33.97 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.509 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 1.3 t80 -80.5 -59.06 2.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 114.207 -1.36 . . . . 0.0 113.211 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.7 -24.73 62.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.378 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.38 -51.61 61.97 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.88 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.558 ' HB3' ' CE2' ' B' ' 38' ' ' PHE . 7.1 m-85 -80.78 -40.95 24.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.842 0.829 . . . . 0.0 109.564 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -62.58 -12.94 25.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.158 -1.383 . . . . 0.0 112.327 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -70.2 65.3 0.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.495 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -81.67 -51.87 7.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.885 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.75 174.55 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.62 -27.61 56.73 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.474 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -101.35 32.51 3.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.35 . . . . 0.0 110.9 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -148.01 140.16 24.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.834 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.58 ' O ' HG13 ' B' ' 28' ' ' VAL . 10.9 p -140.13 63.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.127 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.525 HG22 ' HA ' ' B' ' 72' ' ' ASP . 9.5 p -148.18 -179.42 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.906 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.688 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -138.95 -161.07 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.019 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.625 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -136.68 132.32 34.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.783 0.325 . . . . 0.0 110.359 178.809 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.65 -40.71 40.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.951 0.405 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.715 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.06 -41.53 61.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.538 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' B' ' 38' ' ' PHE . 2.0 mt-10 -58.96 -32.36 69.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 109.786 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.705 ' HD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -69.07 -26.81 65.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.446 179.237 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.6 -59.26 5.09 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.455 ' O ' HG22 ' B' ' 41' ' ' THR . 14.6 m -60.04 -45.19 93.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.206 -178.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.638 ' HE2' HD11 ' B' ' 30' ' ' LEU . 2.5 m-30 -57.8 -26.75 62.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.973 0.416 . . . . 0.0 110.729 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.619 ' HG2' HG21 ' B' ' 47' ' ' THR . 2.7 ttm -78.22 -56.15 4.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.916 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -57.58 -19.61 26.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.071 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.978 HG23 ' HG2' ' B' ' 42' ' ' GLU . 10.7 t -96.73 -30.81 13.0 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.978 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -127.38 -37.46 2.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.587 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 10' ' ' ILE . 7.9 mt -106.93 35.41 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.268 0.556 . . . . 0.0 110.234 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -77.18 -28.6 54.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.777 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' ALA . . . . . 0.46 ' HA ' ' HG2' ' B' ' 48' ' ' LYS . . . -54.11 -27.5 33.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.76 179.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.423 ' CZ ' ' CD2' ' B' ' 88' ' ' HIS . 3.5 m-85 -86.41 -28.31 23.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.659 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.619 HG21 ' HG2' ' B' ' 39' ' ' MET . 29.7 p -83.77 -33.35 25.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.142 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' B' ' 45' ' ' ALA . 1.5 pttt -73.02 -31.71 64.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -115.91 44.51 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 0.0 110.575 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.406 ' HG2' ' HA ' ' B' ' 47' ' ' THR . 1.5 mm-40 -60.39 -61.13 2.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.284 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 59.35 25.76 14.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.483 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.465 ' HA ' ' HD3' ' B' ' 53' ' ' PRO . 0.1 OUTLIER -174.61 118.65 0.34 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.606 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 53' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' B' ' 52' ' ' ASP . 3.0 Cg_exo -75.08 12.26 1.28 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.757 2.304 . . . . 0.0 113.076 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.16 7.61 23.17 Favored Glycine 0 C--N 1.333 0.374 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.938 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.827 HG22 ' HB1' ' B' ' 86' ' ' ALA . 53.7 t -84.09 -62.81 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 0.0 111.039 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.676 HD23 ' C ' ' B' ' 56' ' ' LEU . 6.6 tt -66.72 -51.98 49.74 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.662 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -26.82 47.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.069 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.83 -52.94 63.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.978 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.906 ' HE2' HD21 ' B' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.52 55.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.027 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.848 ' HE3' HD21 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -54.77 -37.81 66.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.567 -179.373 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -78.12 -30.92 49.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.96 0.409 . . . . 0.0 110.67 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -22.98 40.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.978 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.885 ' HB3' HD11 ' B' ' 79' ' ' LEU . 2.2 pp -81.42 7.23 12.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -59.55 68.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.001 0.429 . . . . 0.0 110.044 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.755 HD23 ' O ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER -76.21 159.85 30.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.094 -179.069 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 -94.63 20.83 8.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.42 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.89 -31.77 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.648 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 49.74 28.15 2.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -123.52 -60.68 0.19 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.652 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.502 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 6.3 mm100 -151.39 -177.81 6.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.683 0.278 . . . . 0.0 111.407 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.861 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -64.46 -133.62 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.525 ' HA ' HG22 ' B' ' 29' ' ' THR . 1.7 t0 175.43 -169.55 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 118.805 0.73 . . . . 0.0 111.458 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 38.6 p90 -73.61 -58.88 3.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.509 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.06 -25.5 40.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.104 179.408 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.861 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.2 OUTLIER -44.93 -32.63 1.68 Allowed 'General case' 0 CA--C 1.522 -0.115 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.438 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.565 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 t80 -80.2 -54.01 6.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.555 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' A' ' 77' ' ' LEU . 7.1 mt -56.97 -33.63 67.27 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.902 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -74.95 -42.07 58.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.885 HD11 ' HB3' ' B' ' 63' ' ' LEU . 1.2 mp -65.95 -57.2 8.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.129 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.896 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.21 -44.57 64.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.923 179.353 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.6 -50.3 49.29 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.17 -1.014 . . . . 0.0 110.761 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.561 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.63 -40.07 47.23 Favored Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.231 -0.985 . . . . 0.0 111.618 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.906 HD21 ' HE2' ' B' ' 59' ' ' MET . 7.0 mt -59.16 -46.39 88.5 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.828 0.347 . . . . 0.0 110.264 178.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.717 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.44 -33.76 63.89 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.23 0.538 . . . . 0.0 111.209 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.831 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -82.64 -17.1 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.235 -179.351 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -116.85 11.97 14.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.863 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.435 ' N ' HG22 ' B' ' 92' ' ' VAL . 18.7 t -152.78 -39.46 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.103 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.0 OUTLIER -89.8 -85.24 0.21 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.856 -179.196 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' B' ' 85' ' ' VAL . 0.1 OUTLIER -133.04 177.22 7.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.749 0.309 . . . . 0.0 111.079 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' B' ' 91' ' ' PHE . 70.5 m 60.87 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.655 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.454 ' CZ ' ' NE2' ' B' ' 98' ' ' GLN . 0.1 OUTLIER 76.19 -49.48 0.59 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.226 -179.739 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.435 HG22 ' N ' ' B' ' 87' ' ' CYS . 36.0 t -43.38 -53.54 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.32 26.27 3.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.171 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -158.84 27.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.086 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.725 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . . . -90.46 -68.89 0.1 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.421 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.725 ' CD ' ' HB3' ' B' ' 95' ' ' ALA . 5.8 Cg_endo -46.96 -35.9 19.35 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.785 2.323 . . . . 0.0 113.766 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.592 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 5.6 Cg_exo -74.93 -27.61 10.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.27 1.98 . . . . 0.0 111.985 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.454 ' NE2' ' CZ ' ' B' ' 91' ' ' PHE . 0.0 OUTLIER -57.67 -51.54 69.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.992 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.36 128.44 44.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.96 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -77.07 124.37 27.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.919 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.8 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.744 0.307 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.429 ' CB ' ' HG3' ' A' ' 7' ' ' GLU . 1.1 mpt_? 58.13 105.35 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.955 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -80.89 16.79 1.54 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.256 2.637 . . . . 0.0 114.244 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -54.42 144.28 21.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.566 . . . . 0.0 111.03 -179.35 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.43 -44.24 8.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.321 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.863 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.3 m -71.63 -38.18 70.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.363 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.7 OUTLIER -52.49 -53.33 47.17 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.969 0.414 . . . . 0.0 110.445 179.772 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.08 -26.65 62.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.584 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.573 ' HB3' HD22 ' B' ' 13' ' ' LEU . 74.2 m -74.67 -54.42 7.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.569 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 2.2 mp -54.7 -56.5 10.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.847 0.356 . . . . 0.0 111.574 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.951 ' HA ' HD12 ' A' ' 14' ' ' ILE . 1.8 mt-10 -52.32 -27.46 15.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.847 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -62.88 -55.72 23.59 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.196 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.979 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -74.79 -27.83 60.47 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 6.6 mt -67.2 -35.93 75.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 O-C-N 121.648 -0.657 . . . . 0.0 110.925 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.94 -32.7 45.6 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.455 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.2 m -52.67 -35.83 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 176.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 3.1 t80 -78.02 -59.01 2.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.032 -1.44 . . . . 0.0 110.634 179.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.773 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 3.8 mm-40 -49.61 -45.69 48.38 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -47.91 -51.58 22.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.646 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.4 m-85 -81.17 -31.89 33.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.672 0.749 . . . . 0.0 110.289 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -86.72 20.13 2.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.0 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -158.11 107.02 0.3 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.303 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.73 -49.99 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 111.031 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -160.92 153.12 20.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.93 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.79 -92.19 0.53 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.577 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -109.55 169.4 8.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 110.995 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -161.43 57.02 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.759 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m -116.3 -24.17 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.641 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.49 HG22 ' HA ' ' A' ' 72' ' ' ASP . 3.3 p -140.69 153.13 45.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.137 0.494 . . . . 0.0 111.536 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.663 HD12 ' HE2' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.17 0.51 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.956 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.502 ' H ' HD13 ' A' ' 30' ' ' LEU . 14.0 t -145.25 138.05 26.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.758 0.314 . . . . 0.0 110.455 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.81 -35.85 24.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.813 -179.719 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.703 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.35 -42.85 58.68 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.441 179.484 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -55.92 -29.03 59.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 110.035 179.676 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.581 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -72.21 -32.56 66.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.057 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.703 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -50.02 -59.13 4.19 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.654 0.74 . . . . 0.0 110.913 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.734 ' O ' HG22 ' A' ' 41' ' ' THR . 0.2 OUTLIER -63.79 -44.27 93.87 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.7 -179.141 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 20' ' ' TYR . 32.0 t80 -58.01 -29.64 65.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.821 ' HG2' HG21 ' A' ' 47' ' ' THR . 1.1 ttm -78.08 -46.61 20.34 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.47 -19.74 63.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.028 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.816 HG23 ' HG2' ' A' ' 42' ' ' GLU . 5.9 t -94.35 -35.44 12.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.816 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -128.78 20.23 6.03 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.724 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.5 HD21 HD11 ' B' ' 10' ' ' ILE . 13.7 mt -161.84 44.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.349 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.466 ' HB1' ' HG3' ' A' ' 48' ' ' LYS . . . -75.52 -23.93 56.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.87 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.68 -14.13 62.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.229 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.458 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.2 m-85 -110.97 11.08 22.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.355 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.821 HG21 ' HG2' ' A' ' 39' ' ' MET . 30.0 p -141.51 -34.98 0.47 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.466 ' HG3' ' HB1' ' A' ' 44' ' ' ALA . 37.4 mtpt -40.95 -79.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.742 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -18.09 55.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.207 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 67.78 23.76 8.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.951 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -61.15 141.16 57.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.508 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.627 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . 10.0 t0 64.27 103.46 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -86.77 22.74 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.745 2.296 . . . . 0.0 113.129 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -127.62 -0.56 6.68 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.054 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 1.6 m -84.56 -51.05 14.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.179 0.514 . . . . 0.0 110.844 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.02 -52.01 12.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.908 -179.457 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.817 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.4 t0 -56.45 -29.28 61.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.264 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -52.2 66.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.252 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.897 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.9 ptp -54.95 -52.85 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.927 0.394 . . . . 0.0 111.175 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.5 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -62.77 -27.79 69.53 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.286 -179.424 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -40.21 39.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 0.0 110.391 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -80.13 -22.76 41.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.179 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.993 HD23 HD11 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -58.27 -46.08 86.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 121.108 0.48 . . . . 0.0 110.662 179.794 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 t70 65.07 49.38 2.05 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.51 HD21 ' HG ' ' A' ' 63' ' ' LEU . 2.3 mm? -51.75 94.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.018 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -174.93 -56.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 p -70.27 136.3 49.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.004 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 77.1 -50.38 0.55 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.89 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.62 21.14 20.04 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.043 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.481 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.9 mm100 -159.83 166.82 29.55 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.878 0.371 . . . . 0.0 111.376 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.896 HD13 ' HG2' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -66.41 -139.02 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.255 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.511 ' C ' ' OE1' ' A' ' 75' ' ' GLU . 4.4 p-10 172.48 -157.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.347 0.521 . . . . 0.0 111.777 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.809 ' CD2' HG21 ' B' ' 85' ' ' VAL . 29.7 p90 -84.46 -59.93 2.23 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.524 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 7.9 tp-100 -76.98 -35.13 57.42 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -177.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.896 ' HG2' HD13 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -49.22 -26.53 2.98 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.005 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.663 ' HE2' HD12 ' A' ' 30' ' ' LEU . 1.1 t80 -77.33 -54.05 6.94 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' B' ' 77' ' ' LEU . 8.0 mt -57.79 -33.56 68.69 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -43.35 38.15 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.993 HD11 HD23 ' A' ' 63' ' ' LEU . 2.7 mp -58.08 -57.57 12.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.782 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.962 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.93 -44.17 28.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.061 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.17 51.33 Favored Glycine 0 CA--C 1.508 -0.363 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.732 179.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.29 -41.13 46.89 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.147 -1.025 . . . . 0.0 111.394 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.897 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.6 mt -57.91 -46.8 84.42 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.623 -0.339 . . . . 0.0 110.466 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.441 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.57 -31.95 62.62 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.051 0.453 . . . . 0.0 111.058 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.818 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.17 -17.6 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.512 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -114.03 14.16 18.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.134 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.458 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -156.19 -37.72 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.347 179.636 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 12.7 t-80 -91.11 157.99 16.91 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.891 0.377 . . . . 0.0 111.081 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 93.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.052 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.3 m -150.29 -67.8 0.2 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.601 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.604 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -121.05 -32.54 3.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.01 179.722 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.454 HG13 ' HA ' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -51.94 -25.9 6.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.471 -179.892 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.58 50.93 1.79 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.842 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -154.98 -46.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.576 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -135.3 65.03 62.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.161 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.454 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 48.5 Cg_exo -57.62 -46.89 24.09 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.74 2.294 . . . . 0.0 112.608 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 87.9 Cg_endo -81.1 -39.35 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.392 2.061 . . . . 0.0 112.266 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.576 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.3 OUTLIER -62.51 147.45 48.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.879 -179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.64 104.2 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.05 99.5 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.855 -179.935 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.788 0.328 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.433 ' CB ' ' HG3' ' B' ' 7' ' ' GLU . 1.1 mpt_? 58.15 105.37 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.93 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -80.85 16.72 1.55 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.22 2.613 . . . . 0.0 114.267 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.733 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -54.43 144.34 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.36 0.6 . . . . 0.0 110.964 -179.271 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.45 -44.22 8.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.376 -179.191 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.851 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.6 m -71.75 -38.03 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.35 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.733 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.7 OUTLIER -52.45 -53.36 46.52 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.915 0.388 . . . . 0.0 110.461 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.12 -26.66 62.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.574 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 13' ' ' LEU . 74.2 m -74.59 -54.41 7.52 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.604 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.078 HG22 HD11 ' B' ' 14' ' ' ILE . 2.2 mp -54.72 -56.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 111.615 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.968 ' HA ' HD12 ' B' ' 14' ' ' ILE . 1.8 mt-10 -52.38 -27.34 15.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -63.02 -55.74 23.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.978 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -74.7 -27.83 60.56 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.078 HD11 HG22 ' B' ' 10' ' ' ILE . 6.7 mt -67.22 -35.93 75.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 121.612 -0.68 . . . . 0.0 110.859 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.09 -32.6 44.74 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.459 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.978 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.2 m -52.57 -35.97 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 176.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.566 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.1 t80 -77.92 -59.03 2.95 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 113.923 -1.489 . . . . 0.0 110.683 179.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 3.8 mm-40 -49.68 -45.65 49.02 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -47.79 -51.72 21.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.614 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.525 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.4 m-85 -81.11 -31.91 34.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.627 0.727 . . . . 0.0 110.294 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.485 ' HA ' HD23 ' B' ' 30' ' ' LEU . . . -86.74 20.12 2.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.931 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -158.06 106.93 0.3 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.324 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.61 -50.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.763 0.316 . . . . 0.0 111.106 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -160.88 153.19 20.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.65 -92.07 0.51 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.593 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -109.64 169.44 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.864 0.364 . . . . 0.0 110.892 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 66.8 m -161.4 56.98 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.784 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m -116.32 -24.12 3.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.663 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.486 HG22 ' HA ' ' B' ' 72' ' ' ASP . 3.3 p -140.69 153.19 45.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.291 0.567 . . . . 0.0 111.417 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.661 HD12 ' HE2' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.19 0.51 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.956 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.494 ' H ' HD13 ' B' ' 30' ' ' LEU . 13.9 t -145.28 138.03 26.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.306 . . . . 0.0 110.462 179.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.77 -35.92 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.776 -179.694 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.702 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.22 -42.94 58.95 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.456 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.1 OUTLIER -55.94 -28.96 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.059 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.569 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -72.26 -32.61 66.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.028 178.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -49.96 -59.07 4.23 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.594 0.712 . . . . 0.0 110.863 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.755 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -63.97 -44.09 93.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.631 -178.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.449 ' HB2' ' CZ ' ' B' ' 20' ' ' TYR . 31.9 t80 -58.16 -29.65 65.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.831 ' HG2' HG21 ' B' ' 47' ' ' THR . 1.1 ttm -78.03 -46.64 20.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.946 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.51 -19.63 63.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.082 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.811 HG23 ' HG2' ' B' ' 42' ' ' GLU . 5.9 t -94.45 -35.32 12.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.811 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.1 OUTLIER -128.86 20.3 5.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.804 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.482 HD21 HD11 ' A' ' 10' ' ' ILE . 13.7 mt -161.85 44.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.036 0.446 . . . . 0.0 110.413 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.469 ' HB1' ' HG3' ' B' ' 48' ' ' LYS . . . -75.44 -24.09 57.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.814 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.67 -13.98 62.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.246 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.1 m-85 -111.03 11.12 22.09 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.419 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.831 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p -141.6 -34.87 0.47 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.469 ' HG3' ' HB1' ' B' ' 44' ' ' ALA . 37.4 mtpt -41.0 -79.69 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.718 0.294 . . . . 0.0 111.718 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.07 -18.04 55.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.174 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 67.83 23.68 8.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.747 0.308 . . . . 0.0 110.997 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -61.16 141.16 57.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.501 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.638 ' HB3' ' CG1' ' B' ' 55' ' ' VAL . 10.1 t0 64.31 103.55 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.483 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -86.82 22.73 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.75 2.3 . . . . 0.0 113.185 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -127.6 -0.54 6.69 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.081 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.641 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 1.6 m -84.57 -51.1 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.154 0.502 . . . . 0.0 110.834 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.807 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.03 -51.91 12.39 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.944 -179.434 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.807 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.4 t0 -56.56 -29.27 61.81 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.282 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -52.19 66.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.245 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.938 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.9 ptp -54.89 -52.9 61.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 111.236 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.493 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -62.72 -27.7 69.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.36 -179.486 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -40.14 38.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.423 . . . . 0.0 110.446 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -80.15 -22.73 41.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.177 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.992 HD23 HD11 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -58.33 -46.07 86.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.068 0.461 . . . . 0.0 110.599 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 t70 65.13 49.31 2.03 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.954 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.495 HD21 ' HG ' ' B' ' 63' ' ' LEU . 2.3 mm? -51.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.051 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -175.02 -56.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.5 p -70.31 136.28 49.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.937 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 77.1 -50.25 0.55 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.871 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.49 21.19 20.21 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.057 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.471 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.8 mm100 -159.92 166.72 29.59 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.97 0.414 . . . . 0.0 111.324 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.847 HD13 ' HG2' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -66.36 -139.02 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.212 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.504 ' C ' ' OE1' ' B' ' 75' ' ' GLU . 4.4 p-10 172.47 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.383 0.538 . . . . 0.0 111.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CG ' HG11 ' A' ' 85' ' ' VAL . 29.7 p90 -84.45 -59.92 2.23 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -178.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.51 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 7.9 tp-100 -76.94 -35.11 57.51 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.847 ' HG2' HD13 ' B' ' 71' ' ' LEU . 0.8 OUTLIER -49.25 -26.63 3.11 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.925 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.661 ' HE2' HD12 ' B' ' 30' ' ' LEU . 1.1 t80 -77.25 -54.08 6.93 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' A' ' 77' ' ' LEU . 8.0 mt -57.77 -33.51 68.58 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.71 -43.35 37.88 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.992 HD11 HD23 ' B' ' 63' ' ' LEU . 2.7 mp -58.2 -57.46 12.78 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.796 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 1.0 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.92 -44.18 28.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.09 179.406 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -50.11 51.66 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.178 -1.01 . . . . 0.0 110.747 179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.32 -41.16 47.18 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.375 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.938 HD21 ' HE2' ' B' ' 59' ' ' MET . 6.4 mt -57.87 -46.85 84.23 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.438 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.47 -31.98 62.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.143 0.497 . . . . 0.0 111.205 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.809 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.15 -17.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.586 -179.469 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.641 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -113.96 14.01 18.37 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.162 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.448 ' HB3' ' CD2' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -156.12 -37.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.321 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.7 t-80 -91.02 157.98 16.95 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.879 0.371 . . . . 0.0 111.118 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.38 93.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.975 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.6 m -150.43 -67.69 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.612 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -121.11 -32.59 3.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.96 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.444 HG13 ' HA ' ' B' ' 86' ' ' ALA . 0.9 OUTLIER -51.86 -25.99 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.53 -179.908 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.5 50.79 1.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.951 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -154.84 -46.28 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.217 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.576 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -135.38 65.14 62.09 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.449 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 48.8 Cg_exo -57.64 -46.78 24.73 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.673 2.249 . . . . 0.0 112.648 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 86.3 Cg_endo -81.09 -39.38 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.41 2.073 . . . . 0.0 112.345 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.576 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -62.51 147.51 48.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.911 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.65 104.15 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.03 99.53 0.64 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.86 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.834 179.98 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.805 0.336 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.6 87.46 5.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.848 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -71.4 -2.86 11.92 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.003 2.468 . . . . 0.0 113.459 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.77 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -139.21 145.52 39.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.476 0.655 . . . . 0.0 111.702 -179.746 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.48 -48.97 37.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.755 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.941 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.4 m -60.49 -37.57 81.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.078 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.77 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.7 -36.64 47.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.46 -26.96 41.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.342 178.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -65.37 -45.31 84.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.288 -179.714 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.134 HG22 HD11 ' A' ' 14' ' ' ILE . 3.2 mp -63.05 -56.77 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.46 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.72 -179.455 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.74 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.871 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.929 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -71.97 -27.22 62.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.134 HD11 HG22 ' A' ' 10' ' ' ILE . 7.8 mt -66.9 -36.02 76.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.944 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.75 -35.67 60.11 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.35 -1.296 . . . . 0.0 112.473 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.929 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.9 m -56.82 -35.68 47.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.479 0.657 . . . . 0.0 109.742 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 14.6 t80 -80.22 -59.91 2.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.757 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.905 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 3.9 pt20 -66.51 -29.63 69.77 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.43 -51.68 52.71 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.323 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.523 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.0 m-85 -80.35 -40.03 27.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.69 0.757 . . . . 0.0 109.538 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.905 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.89 -24.47 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.608 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 169.35 86.85 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.443 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 -40.61 65.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.292 . . . . 0.0 110.833 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.25 100.98 8.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.29 -163.72 12.95 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -58.42 -178.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.778 0.323 . . . . 0.0 110.892 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.38 97.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.12 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p -113.37 -39.8 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.718 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 20.8 p -136.4 -177.45 4.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.71 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -129.68 -128.24 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.632 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.631 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -170.97 130.47 0.79 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.409 ' CE ' ' HG2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.33 43.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.944 0.402 . . . . 0.0 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.695 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.33 -43.42 56.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.482 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.7 mt-10 -55.82 -29.15 59.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.01 0.433 . . . . 0.0 110.428 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.509 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 6.8 t80 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.371 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.695 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.76 -59.04 5.61 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.686 0.755 . . . . 0.0 111.3 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.891 ' O ' HG22 ' A' ' 41' ' ' THR . 0.7 OUTLIER -58.24 -32.52 68.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.274 -178.488 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -57.78 -38.18 75.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.696 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -74.61 -35.4 62.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.201 0.524 . . . . 0.0 110.338 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -73.27 -19.25 61.1 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.46 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 37' ' ' SER . 3.7 t -107.65 -43.57 4.47 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -178.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.62 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.2 mm-40 -127.85 -18.42 4.26 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -176.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 10' ' ' ILE . 9.4 mt -120.27 49.56 1.41 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.273 0.559 . . . . 0.0 110.183 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -82.93 -29.37 29.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.926 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.75 30.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.59 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 87' ' ' CYS . 47.8 m-85 -95.79 20.48 9.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t 178.43 39.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.745 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -102.09 -39.16 7.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.54 -25.01 14.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.784 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.41 41.72 4.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.082 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -51.29 -27.84 10.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.659 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -153.15 126.04 4.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.418 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.46 23.87 0.8 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.645 2.23 . . . . 0.0 112.88 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.424 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -124.32 4.3 8.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.976 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 86' ' ' ALA . 53.9 t -84.3 -63.99 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.946 0.373 . . . . 0.0 111.392 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -76.51 -52.57 9.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.066 0.46 . . . . 0.0 112.017 -179.491 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.822 ' N ' HD23 ' A' ' 56' ' ' LEU . 10.2 t0 -55.38 -59.08 5.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.196 -178.114 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 7.6 mmt180 -58.8 -35.59 73.09 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.832 ' HE2' HD21 ' A' ' 83' ' ' LEU . 3.2 tmm? -75.51 -43.78 47.18 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 120.426 0.155 . . . . 0.0 111.413 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.728 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -66.59 -37.35 84.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.856 0.36 . . . . 0.0 110.443 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.8 mtpt -78.4 -46.75 19.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.111 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.19 6.1 12.69 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.842 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.753 ' CG ' HD23 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -60.23 -11.4 6.23 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.701 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.2 OUTLIER 78.48 91.05 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.873 0.368 . . . . 0.0 110.979 179.792 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.753 HD23 ' CG ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -134.57 55.05 1.91 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.685 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -78.27 64.68 3.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.908 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.54 29.96 17.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.997 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -61.31 -46.91 88.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.811 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 139.71 77.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.525 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.432 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 3.4 mm100 61.47 -170.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.697 0.284 . . . . 0.0 110.865 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -65.0 -137.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 22.9 t70 171.78 161.24 0.1 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.436 0.562 . . . . 0.0 111.492 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.941 ' CG ' HG11 ' B' ' 85' ' ' VAL . 35.9 p90 -52.14 -59.77 3.99 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.644 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.42 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -79.66 -22.9 42.94 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.261 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.942 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.4 tt0 -45.41 -43.68 11.45 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.6 t80 -71.32 -54.41 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.301 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.472 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -51.19 -38.56 52.99 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.183 0.516 . . . . 0.0 109.74 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -76.39 -36.72 57.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.494 -0.776 . . . . 0.0 108.991 178.028 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.27 -57.54 8.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.288 -179.514 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.89 -43.84 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 178.636 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.45 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -54.2 -50.99 53.68 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.65 179.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.58 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.05 -41.64 60.27 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.867 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.832 HD21 ' HE2' ' A' ' 59' ' ' MET . 3.3 mt -61.86 -42.26 98.84 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -54.42 -32.43 57.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.374 0.607 . . . . 0.0 110.188 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.932 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.67 -17.78 9.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.553 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.494 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.87 14.5 19.81 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.143 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 46' ' ' PHE . 52.8 t -157.94 -42.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.926 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.413 ' ND1' HD13 ' B' ' 14' ' ' ILE . 15.0 t-80 -90.31 162.93 14.95 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.872 0.368 . . . . 0.0 110.963 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.18 112.64 1.79 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.081 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.65 -53.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.808 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -127.39 -45.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.691 179.85 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.486 HG11 ' C ' ' A' ' 86' ' ' ALA . 30.8 m -60.26 -34.14 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.39 9.7 30.58 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.414 ' C ' ' HD3' ' A' ' 96' ' ' PRO . . . -137.2 29.38 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.901 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -129.54 57.94 34.07 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.566 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.459 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 52.6 Cg_exo -53.92 -47.12 28.86 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.332 2.021 . . . . 0.0 112.386 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 12.1 Cg_exo -69.57 -32.28 19.67 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.349 2.032 . . . . 0.0 111.581 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.901 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.9 OUTLIER -59.28 87.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.82 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.2 pttt -104.52 148.29 26.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.016 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -34.22 61.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.94 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.914 179.955 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.833 0.349 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.53 87.45 5.98 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -71.44 -2.86 11.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 123.007 2.471 . . . . 0.0 113.414 -179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.761 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -139.14 145.48 39.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.475 0.655 . . . . 0.0 111.713 -179.784 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.37 -49.07 36.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.752 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.912 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.4 m -60.44 -37.55 81.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.089 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.761 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -36.69 48.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.008 0.432 . . . . 0.0 110.274 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -26.95 42.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.413 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.47 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.5 OUTLIER -65.44 -45.3 84.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.227 -179.664 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' B' ' 14' ' ' ILE . 3.2 mp -63.1 -56.75 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.434 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.702 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.508 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.86 13.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.795 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.928 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -71.92 -27.16 62.64 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' B' ' 10' ' ' ILE . 7.8 mt -66.92 -36.04 76.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 O-C-N 121.751 -0.593 . . . . 0.0 110.998 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.76 60.36 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 112.474 -176.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.928 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.1 m -56.85 -35.63 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.458 0.647 . . . . 0.0 109.748 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.511 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 14.8 t80 -80.16 -59.98 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.737 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 4.0 pt20 -66.44 -29.68 69.87 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.47 -51.68 52.96 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.318 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.52 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.0 m-85 -80.3 -39.99 27.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.708 0.766 . . . . 0.0 109.66 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.883 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -56.91 -24.41 52.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.623 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . 169.37 86.78 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.459 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -40.63 65.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.899 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.25 101.05 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.864 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.29 -163.71 12.96 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.547 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -58.41 -178.35 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.705 0.288 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.46 98.01 0.79 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.403 HG13 ' N ' ' B' ' 29' ' ' THR . 13.9 p -113.52 -39.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.776 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.722 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 20.6 p -136.4 -177.39 4.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.609 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.689 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -129.67 -128.24 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.61 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.624 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -170.96 130.5 0.79 Allowed 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.404 ' CE ' ' HG2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.31 43.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.017 -179.533 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.36 -43.33 57.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.997 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.474 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.7 mt-10 -55.99 -29.02 59.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.079 0.466 . . . . 0.0 110.425 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 6.9 t80 -72.77 -27.0 61.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.289 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.64 -59.02 5.62 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.597 0.713 . . . . 0.0 111.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.87 ' O ' HG22 ' B' ' 41' ' ' THR . 0.7 OUTLIER -58.23 -32.51 68.39 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.303 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.78 -38.2 75.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.693 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -74.65 -35.33 62.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.154 0.502 . . . . 0.0 110.326 179.459 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -73.28 -19.17 61.11 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.476 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.87 HG22 ' O ' ' B' ' 37' ' ' SER . 3.7 t -107.61 -43.71 4.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.2 mm-40 -127.76 -18.53 4.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -176.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.724 HD21 HD11 ' A' ' 10' ' ' ILE . 9.4 mt -120.14 49.51 1.4 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.312 0.577 . . . . 0.0 110.304 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -82.94 -29.3 29.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.919 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.74 30.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.57 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.415 ' CD1' ' HB3' ' B' ' 87' ' ' CYS . 47.4 m-85 -95.86 20.52 9.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.725 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.7 t 178.47 39.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.709 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -102.11 -39.07 7.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.896 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.56 -25.01 14.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.736 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.49 41.64 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -51.26 -27.79 10.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.75 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -153.23 126.01 4.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.436 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.45 24.03 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.572 2.181 . . . . 0.0 112.921 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -124.37 4.16 8.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.922 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.486 HG13 ' HB3' ' B' ' 86' ' ' ALA . 54.2 t -84.28 -63.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.977 0.389 . . . . 0.0 111.377 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.834 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -76.49 -52.59 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.056 0.455 . . . . 0.0 112.03 -179.532 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.834 ' N ' HD23 ' B' ' 56' ' ' LEU . 10.2 t0 -55.34 -59.07 5.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.273 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 7.6 mmt180 -58.8 -35.68 73.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.838 ' HE2' HD21 ' B' ' 83' ' ' LEU . 3.2 tmm? -75.38 -43.88 47.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.436 0.16 . . . . 0.0 111.41 -179.579 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.719 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -66.55 -37.42 84.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.858 0.361 . . . . 0.0 110.428 179.793 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -78.33 -46.78 19.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 6.13 12.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.888 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.755 ' CG ' HD23 ' B' ' 65' ' ' LEU . 0.5 OUTLIER -60.26 -11.39 6.27 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.699 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.2 OUTLIER 78.58 90.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.779 0.323 . . . . 0.0 111.01 179.781 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.755 HD23 ' CG ' ' B' ' 63' ' ' LEU . 0.9 OUTLIER -134.56 55.1 1.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.68 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -78.25 64.7 3.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.883 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.55 29.88 17.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.986 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -61.28 -46.93 88.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.828 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 139.73 77.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.51 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 3.4 mm100 61.4 -170.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.868 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -65.1 -138.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.591 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 22.8 t70 171.78 161.3 0.1 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.453 0.569 . . . . 0.0 111.462 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.932 ' CG ' HG11 ' A' ' 85' ' ' VAL . 35.6 p90 -52.16 -59.79 3.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.626 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.42 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -79.69 -22.91 42.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.16 -179.32 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.945 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.4 tt0 -45.42 -43.7 11.49 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.53 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.6 t80 -71.3 -54.39 10.99 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.356 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.47 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.3 mt -51.21 -38.65 53.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.195 0.521 . . . . 0.0 109.667 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.407 ' ND2' ' C ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -76.37 -36.58 58.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.049 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.945 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.36 -57.63 7.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.264 -179.564 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.71 -43.82 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.419 178.619 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.453 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -54.13 -51.0 53.35 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.141 -1.028 . . . . 0.0 110.705 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.582 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.07 -41.64 60.46 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.895 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.838 HD21 ' HE2' ' B' ' 59' ' ' MET . 3.4 mt -61.91 -42.28 98.91 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.27 -32.53 56.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.941 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.621 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.486 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.01 14.58 19.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.077 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.415 ' HB3' ' CD1' ' B' ' 46' ' ' PHE . 52.9 t -158.03 -42.27 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.404 ' ND1' HD13 ' A' ' 14' ' ' ILE . 14.8 t-80 -90.32 162.93 14.94 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.821 0.343 . . . . 0.0 110.972 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.21 112.61 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.67 -53.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.847 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -127.54 -45.58 1.48 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.711 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.479 HG11 ' C ' ' B' ' 86' ' ' ALA . 30.9 m -60.25 -34.13 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.031 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.41 9.71 30.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.953 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 94' ' ' ALA . . . . . 0.405 ' C ' ' HD3' ' B' ' 96' ' ' PRO . . . -137.27 29.34 2.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.987 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.911 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -129.49 57.95 34.08 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.456 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 52.7 Cg_exo -53.93 -47.07 29.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.335 2.024 . . . . 0.0 112.482 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 12.1 Cg_exo -69.6 -32.19 19.73 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.306 2.004 . . . . 0.0 111.658 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.911 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.9 OUTLIER -59.36 87.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.797 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -104.45 148.27 26.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -34.33 61.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.331 -0.842 . . . . 0.0 110.827 -179.95 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.828 0.347 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.19 128.18 0.92 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -68.3 -102.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.732 2.288 . . . . 0.0 112.196 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -170.75 144.26 2.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.351 0.596 . . . . 0.0 111.156 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.96 -49.07 11.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.998 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.965 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.6 OUTLIER -62.55 -40.42 96.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.087 179.121 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.1 -36.64 41.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.633 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.67 -26.89 40.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.707 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.627 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.6 p -66.86 -42.2 86.08 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.513 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.04 HG22 HD11 ' A' ' 14' ' ' ILE . 3.5 mp -70.98 -54.65 16.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.776 0.322 . . . . 0.0 111.682 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.973 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.94 -27.28 12.63 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -178.606 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.622 ' O ' HG13 ' A' ' 16' ' ' VAL . 16.6 m -75.73 -55.87 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.777 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.808 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.8 mm? -58.82 -27.06 64.72 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.04 HD11 HG22 ' A' ' 10' ' ' ILE . 8.8 mt -73.54 -38.67 52.85 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 CA-C-O 121.489 0.661 . . . . 0.0 110.357 178.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 19' ' ' LYS . . . -73.63 -37.15 65.46 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.787 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -56.81 -36.29 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-O 121.463 0.649 . . . . 0.0 109.815 178.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.499 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 4.2 t80 -79.81 -59.92 2.55 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.664 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.9 pt20 -64.42 -39.45 93.86 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 11.7 tppt? -47.89 -50.69 25.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.812 0.339 . . . . 0.0 110.817 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -79.35 -39.83 31.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.769 0.795 . . . . 0.0 109.344 178.464 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.819 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.36 -19.02 43.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.24 -1.345 . . . . 0.0 112.063 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -119.69 -35.95 0.87 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.627 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt 68.18 -66.72 0.22 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.788 0.328 . . . . 0.0 110.692 -179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -110.18 27.72 9.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.764 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.49 -97.39 0.18 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.519 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -171.95 136.17 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -140.55 25.93 2.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.192 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.433 ' O ' ' OG1' ' A' ' 29' ' ' THR . 28.5 t 64.59 135.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.215 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 28' ' ' VAL . 3.5 p 56.33 154.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.817 -0.628 . . . . 0.0 111.375 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.62 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -101.99 -128.9 0.23 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.27 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.472 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -171.81 123.79 0.53 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.391 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -49.68 -36.33 24.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.128 -179.244 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.21 -42.0 60.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.646 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.38 -28.59 68.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.114 0.483 . . . . 0.0 109.963 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -72.05 -31.62 66.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.958 179.166 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -50.87 -59.17 4.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.683 0.754 . . . . 0.0 111.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -55.18 28.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.446 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.51 ' CD2' ' CG ' ' A' ' 20' ' ' TYR . 21.2 m-85 -57.91 -35.6 71.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.166 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.622 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.1 OUTLIER -72.61 -27.6 62.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.602 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.802 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 6.2 m120 -73.71 -19.6 60.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.719 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.49 -80.74 0.58 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.669 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.39 -30.66 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.781 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.556 HD21 HD11 ' B' ' 10' ' ' ILE . 30.5 mt -133.64 51.67 2.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.004 0.43 . . . . 0.0 110.761 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.802 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -78.78 -41.49 30.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.884 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.87 24.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.245 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -82.6 -40.53 20.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.622 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.9 p -88.81 -84.93 0.2 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.807 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.482 ' N ' ' OG1' ' A' ' 47' ' ' THR . 6.4 mmmt 36.56 -96.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.831 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -157.92 43.87 0.32 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.897 0.38 . . . . 0.0 110.662 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -52.65 -178.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.133 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.54 27.16 3.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.824 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -145.07 101.23 4.49 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.766 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.23 2.2 7.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.527 2.152 . . . . 0.0 112.862 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.45 -23.16 24.83 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.821 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 86' ' ' ALA . 34.6 t -47.99 -61.44 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.771 0.32 . . . . 0.0 111.406 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.61 ' O ' ' HG2' ' A' ' 59' ' ' MET . 10.8 tp -68.69 -45.11 72.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.557 0.694 . . . . 0.0 110.465 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 1.8 t70 -55.6 -26.51 44.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.846 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.14 -53.67 10.43 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.471 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.954 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -55.92 -53.79 52.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.004 0.431 . . . . 0.0 111.633 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.517 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -65.14 -22.8 66.98 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.083 -179.097 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -67.87 -61.08 2.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.849 0.357 . . . . 0.0 111.416 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.86 -26.42 68.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.95 ' HB2' HD11 ' A' ' 79' ' ' LEU . 1.7 tt -60.16 -19.24 52.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t70 63.93 54.9 1.66 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 0.0 109.864 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' A' ' 63' ' ' LEU . 35.7 mt -39.13 113.38 0.31 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.876 -179.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.02 133.33 13.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.697 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.7 m -77.17 -22.61 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.229 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -94.13 42.71 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.844 0.354 . . . . 0.0 110.978 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.449 ' O ' ' HG2' ' A' ' 70' ' ' GLN . . . -154.93 -119.54 0.68 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.516 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 69' ' ' GLY . 1.5 mm-40 167.46 167.25 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.762 0.315 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.865 HD21 HD11 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -70.39 -138.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.136 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.512 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.5 OUTLIER 172.39 179.04 0.08 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 118.516 0.598 . . . . 0.0 111.715 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.2 p90 -64.78 -57.65 8.35 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.336 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -78.81 -20.99 48.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.076 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -45.1 -36.86 3.87 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 35' ' ' PHE . 2.9 t80 -80.2 -54.24 5.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.799 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -51.83 -34.09 38.9 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.175 0.512 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.41 ' HB3' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.41 -48.99 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.223 178.009 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.95 HD11 ' HB2' ' A' ' 63' ' ' LEU . 5.3 mp -59.78 -58.19 9.65 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.868 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.786 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -71.24 -46.46 65.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.843 179.576 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.552 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.84 -50.35 50.53 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.102 -1.047 . . . . 0.0 110.525 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.462 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -52.11 -32.79 36.29 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.583 178.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.954 HD21 ' HE3' ' A' ' 59' ' ' MET . 14.1 mt -64.48 -46.6 82.32 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 120.901 0.381 . . . . 0.0 110.12 179.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.571 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.09 -32.87 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.625 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.905 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.6 9.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.403 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.94 12.75 14.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.671 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.491 ' N ' ' O ' ' A' ' 83' ' ' LEU . 53.6 t -152.45 -43.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.879 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -84.11 148.82 26.59 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.75 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.36 85.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.213 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' PHE . 41.0 p -179.59 102.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.744 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.575 ' CB ' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 82.85 -30.13 0.09 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.8 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 85' ' ' VAL . 60.4 t -52.33 100.84 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 tttp 54.48 28.63 9.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.112 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.594 ' HB1' ' HG2' ' A' ' 97' ' ' PRO . . . 57.73 54.07 6.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.148 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.644 ' HB3' ' CD ' ' A' ' 96' ' ' PRO . . . -64.01 -64.25 3.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.097 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.644 ' CD ' ' HB3' ' A' ' 95' ' ' ALA . 0.9 OUTLIER -40.78 -54.17 2.52 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.405 2.736 . . . . 0.0 113.242 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.594 ' HG2' ' HB1' ' A' ' 94' ' ' ALA . 44.4 Cg_endo -67.41 -9.75 26.36 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.354 2.036 . . . . 0.0 112.712 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -94.25 29.8 2.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.33 . . . . 0.0 111.183 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.8 mttm 57.23 -169.89 0.1 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.078 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 75.2 ttt-85 -83.65 -66.87 0.84 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 38.6 p90 . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.914 -179.954 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 95.1 p . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.809 0.337 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.17 128.16 0.92 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.978 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -68.26 -102.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.715 2.276 . . . . 0.0 112.273 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.715 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -170.72 144.24 2.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 111.145 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -49.11 11.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.998 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.977 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.6 OUTLIER -62.44 -40.44 96.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.025 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.16 -36.58 41.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.61 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.77 -26.88 40.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.66 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -66.79 -42.26 86.28 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.519 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 0.989 HG22 HD11 ' B' ' 14' ' ' ILE . 3.5 mp -71.04 -54.63 16.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.597 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.992 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.01 -27.27 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.529 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' B' ' 16' ' ' VAL . 16.6 m -75.67 -55.83 5.27 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.909 -0.317 . . . . 0.0 111.833 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 0.814 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -58.83 -27.17 64.85 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' B' ' 11' ' ' GLU . 8.8 mt -73.44 -38.73 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 CA-C-O 121.433 0.635 . . . . 0.0 110.34 178.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' B' ' 19' ' ' LYS . . . -73.62 -37.1 65.49 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.824 -177.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.814 HG22 ' O ' ' B' ' 13' ' ' LEU . 18.8 m -56.85 -36.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.429 0.633 . . . . 0.0 109.81 178.348 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.497 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 4.2 t80 -79.8 -60.03 2.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.661 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.9 pt20 -64.34 -39.48 93.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' B' ' 15' ' ' ALA . 11.7 tppt? -47.9 -50.68 25.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.852 0.358 . . . . 0.0 110.888 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.518 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -79.25 -39.88 31.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.8 0.81 . . . . 0.0 109.335 178.404 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.842 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.45 -19.04 44.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.985 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -119.74 -35.74 0.89 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.663 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt 68.19 -66.75 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.676 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -110.12 27.65 9.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.767 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.48 -97.28 0.18 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.525 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -171.99 136.08 0.86 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.803 0.335 . . . . 0.0 110.802 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 29.6 t -140.49 25.91 2.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.142 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' VAL . . . . . 0.407 ' O ' ' OG1' ' B' ' 29' ' ' THR . 28.8 t 64.67 135.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.221 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' B' ' 28' ' ' VAL . 3.7 p 56.39 154.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.392 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.591 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -102.02 -128.91 0.23 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.255 -179.846 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.479 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -171.76 123.83 0.54 Allowed 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.457 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.0 OUTLIER -49.64 -36.38 24.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.087 -179.207 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.16 -42.11 60.45 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.28 -28.69 68.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 109.925 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -71.95 -31.72 66.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.207 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -50.81 -59.26 4.29 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.588 0.709 . . . . 0.0 111.49 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -55.14 29.45 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.578 -1.192 . . . . 0.0 111.527 -178.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.517 ' CD2' ' CG ' ' B' ' 20' ' ' TYR . 21.1 m-85 -57.87 -35.65 71.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.146 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.614 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.1 OUTLIER -72.63 -27.61 62.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.541 179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.788 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 6.2 m120 -73.62 -19.7 60.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.7 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.37 -80.93 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.668 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.28 -30.6 3.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.848 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.553 HD21 HD11 ' A' ' 10' ' ' ILE . 30.3 mt -133.74 51.65 2.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.813 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.788 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -78.74 -41.53 30.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.835 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.8 23.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -82.73 -40.52 20.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.614 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p -88.76 -84.93 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.48 ' N ' ' OG1' ' B' ' 47' ' ' THR . 6.5 mmmt 36.58 -96.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -157.89 43.87 0.32 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.817 0.342 . . . . 0.0 110.624 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -52.62 -178.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.103 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.59 27.18 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.867 179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -145.1 101.29 4.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.23 2.13 7.56 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.617 2.211 . . . . 0.0 112.839 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.47 -23.17 24.74 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.767 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 86' ' ' ALA . 34.1 t -48.04 -61.41 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.696 0.284 . . . . 0.0 111.409 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.6 ' O ' ' HG2' ' B' ' 59' ' ' MET . 10.7 tp -68.66 -45.11 72.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.578 0.704 . . . . 0.0 110.502 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 1.8 t70 -55.49 -26.6 43.56 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.856 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.21 -53.65 10.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.387 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.958 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -55.9 -53.79 52.51 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.018 0.437 . . . . 0.0 111.6 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.538 ' HE3' ' HG ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -65.1 -22.74 66.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.147 -179.135 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -68.02 -61.04 2.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.731 0.3 . . . . 0.0 111.33 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -26.3 68.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.804 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.934 ' HB2' HD11 ' B' ' 79' ' ' LEU . 1.7 tt -60.23 -19.15 53.28 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t70 63.83 54.94 1.7 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.032 0.444 . . . . 0.0 109.907 -179.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.904 ' CD2' HD22 ' B' ' 63' ' ' LEU . 35.3 mt -39.07 113.35 0.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.868 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -153.0 133.38 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.653 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 66.3 m -77.29 -22.53 51.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.194 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -94.18 42.71 1.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.864 0.364 . . . . 0.0 110.977 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.441 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . -154.9 -119.6 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.363 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' B' ' 69' ' ' GLY . 1.5 mm-40 167.38 167.23 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.878 HD21 HD11 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -70.41 -138.16 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.209 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.5 OUTLIER 172.38 179.13 0.08 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.463 0.574 . . . . 0.0 111.746 179.723 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.905 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.9 p90 -64.75 -57.73 8.15 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.349 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -78.85 -20.91 48.47 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.027 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.827 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -45.04 -37.01 3.82 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.765 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 3.0 t80 -80.21 -54.16 6.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.792 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' A' ' 77' ' ' LEU . 7.3 mt -51.84 -34.04 38.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.194 0.521 . . . . 0.0 109.733 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.5 -48.98 17.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.172 178.034 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.934 HD11 ' HB2' ' B' ' 63' ' ' LEU . 5.3 mp -59.8 -58.13 9.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.869 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.789 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -71.29 -46.42 65.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.84 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.78 -50.4 49.98 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.126 -1.035 . . . . 0.0 110.555 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.485 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -52.22 -32.69 36.89 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.6 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.958 HD21 ' HE3' ' B' ' 59' ' ' MET . 14.2 mt -64.47 -46.58 82.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.979 0.419 . . . . 0.0 110.134 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.593 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.14 -32.89 62.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.603 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.52 -17.65 9.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.497 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.92 12.94 14.84 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.67 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.494 ' N ' ' O ' ' B' ' 83' ' ' LEU . 53.6 t -152.55 -43.49 0.1 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.495 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.9 OUTLIER -84.22 148.83 26.51 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.764 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.39 85.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' B' ' 91' ' ' PHE . 40.8 p -179.52 102.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.571 ' CB ' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 83.01 -30.15 0.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.765 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 85' ' ' VAL . 60.3 t -52.37 100.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.915 0.388 . . . . 0.0 111.299 -179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 tttp 54.27 28.76 9.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.174 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 94' ' ' ALA . . . . . 0.574 ' HB1' ' HG2' ' B' ' 97' ' ' PRO . . . 57.65 54.19 6.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.076 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.644 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . . . -64.01 -64.26 3.03 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.117 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.644 ' CD ' ' HB3' ' B' ' 95' ' ' ALA . 0.9 OUTLIER -40.87 -54.03 2.62 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.381 2.721 . . . . 0.0 113.207 -179.885 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.574 ' HG2' ' HB1' ' B' ' 94' ' ' ALA . 43.8 Cg_endo -67.53 -9.69 26.23 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.303 2.002 . . . . 0.0 112.711 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -94.23 29.64 2.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.73 0.3 . . . . 0.0 111.115 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 11.8 mttm 57.33 -169.89 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.089 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -83.75 -66.81 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.895 179.976 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.74 0.305 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -99.87 110.75 60.24 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.04 -100.85 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.633 2.222 . . . . 0.0 112.278 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.624 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -175.24 144.97 0.75 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.375 0.607 . . . . 0.0 111.149 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.02 -40.1 6.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.117 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.956 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.7 m -70.16 -37.43 75.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.233 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.624 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.66 60.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.015 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -77.4 -26.82 52.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.608 ' HB3' HD22 ' B' ' 13' ' ' LEU . 81.8 m -72.29 -51.87 18.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 1.079 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -52.89 -56.24 8.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.6 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 1.031 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.3 OUTLIER -52.36 -27.51 15.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -178.846 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -66.01 -55.71 15.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.038 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -71.19 -27.69 63.69 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.079 HD11 HG22 ' A' ' 10' ' ' ILE . 7.7 mt -67.3 -37.45 79.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.546 0.688 . . . . 0.0 110.882 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.03 -32.88 61.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.376 -176.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.038 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.1 m -52.63 -38.21 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.489 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.6 t80 -77.5 -58.05 3.48 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.529 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.81 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 5.8 mm100 -49.13 -35.8 17.41 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.839 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.1 -52.26 59.19 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.294 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.844 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.8 m-85 -81.28 -47.36 13.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.771 0.796 . . . . 0.0 110.093 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.565 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.89 -21.06 26.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.867 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.01 165.1 51.35 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.401 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt 61.22 101.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.801 0.334 . . . . 0.0 110.877 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -162.05 -46.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.87 -37.89 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.603 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -177.26 -39.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 p -57.67 147.76 26.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.979 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -112.37 55.68 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.9 p -133.99 172.75 12.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.297 0.57 . . . . 0.0 110.778 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.844 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -114.38 -144.76 0.39 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.527 ' H ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -160.63 138.11 9.38 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.531 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -41.53 44.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.101 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.735 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.91 -45.31 61.68 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.416 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 3.6 mt-10 -57.57 -28.95 64.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.156 0.503 . . . . 0.0 109.97 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.451 ' CE2' ' CB ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -67.49 -32.97 74.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.805 178.709 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.735 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -51.01 -59.2 4.41 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.515 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.613 ' O ' HG22 ' A' ' 41' ' ' THR . 68.8 m -54.09 -48.64 70.46 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.593 -178.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.527 ' HA ' HG22 ' A' ' 41' ' ' THR . 31.8 t80 -57.92 -27.42 63.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.893 0.377 . . . . 0.0 110.966 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.932 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -73.7 -58.25 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.196 -179.809 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.423 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 1.9 p30 -65.38 -19.36 65.91 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.948 HG23 ' HG2' ' A' ' 42' ' ' GLU . 13.3 t -96.08 -31.73 12.88 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.948 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -129.29 14.67 6.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.826 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.879 HD12 ' HE2' ' A' ' 39' ' ' MET . 40.2 mt -161.93 41.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 109.692 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.578 ' HB1' ' HG3' ' A' ' 48' ' ' LYS . . . -75.67 -26.24 57.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.86 -7.7 36.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.05 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -112.25 -13.84 13.42 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.621 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.932 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.2 p -124.13 -17.49 6.18 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.578 ' HG3' ' HB1' ' A' ' 44' ' ' ALA . 24.7 mttm -47.3 126.49 9.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.973 0.416 . . . . 0.0 111.486 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 63.75 13.73 7.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.37 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.66 30.98 0.41 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-O 120.797 0.332 . . . . 0.0 111.39 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -48.68 -29.39 4.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.939 0.4 . . . . 0.0 110.82 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.734 ' HB3' HG23 ' A' ' 55' ' ' VAL . 0.6 OUTLIER -130.03 88.27 49.03 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.484 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.4 -1.62 7.66 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.872 2.381 . . . . 0.0 113.051 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -98.2 -2.15 58.04 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.881 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.774 HG12 HD22 ' A' ' 83' ' ' LEU . 32.6 t -84.48 -63.2 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.916 0.389 . . . . 0.0 111.352 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.625 ' O ' ' HG3' ' A' ' 59' ' ' MET . 7.0 tp -75.24 -29.54 60.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 111.703 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 19.4 t0 -76.12 -28.19 57.37 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.643 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 7.2 mtt180 -75.24 -45.21 41.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.697 0.284 . . . . 0.0 111.554 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.886 ' HE2' HD21 ' A' ' 83' ' ' LEU . 0.9 OUTLIER -54.35 -54.32 42.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 112.077 -179.283 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.739 ' CE ' HD13 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -70.7 -22.72 62.42 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.517 -179.14 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.568 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -67.98 -60.91 2.14 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.236 178.931 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -14.17 62.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.953 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.995 HD22 ' CD2' ' A' ' 65' ' ' LEU . 4.8 tt -64.05 -8.77 12.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.826 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 63' ' ' LEU . 3.7 t70 82.42 -60.29 0.17 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.963 0.411 . . . . 0.0 110.199 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.995 ' CD2' HD22 ' A' ' 63' ' ' LEU . 1.1 mt 67.65 -159.85 0.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.955 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 64.86 150.23 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.831 0.348 . . . . 0.0 110.757 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.7 p -57.02 89.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.104 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -124.63 -44.26 1.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.66 37.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 3.6 mm100 57.35 -171.36 0.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.608 0.242 . . . . 0.0 110.768 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 72' ' ' ASP . 0.8 OUTLIER -66.43 -146.79 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.396 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.627 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 1.3 p30 170.79 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.221 0.534 . . . . 0.0 112.127 179.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.8 ' CZ ' ' HB1' ' B' ' 84' ' ' ALA . 0.3 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.698 -178.739 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -66.41 -34.01 76.99 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.603 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.919 ' O ' HD23 ' A' ' 79' ' ' LEU . 1.9 tt0 -45.14 -47.09 12.25 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.806 0.336 . . . . 0.0 110.188 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.8 t80 -70.98 -46.45 62.31 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.412 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.702 HD13 ' HA3' ' B' ' 81' ' ' GLY . 7.2 mt -56.81 -40.14 75.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.44 -39.51 53.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.056 178.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -60.26 -58.22 9.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.526 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.637 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.15 -46.08 45.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.706 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.707 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -54.27 -50.33 56.49 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 178.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.405 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.41 -35.53 36.14 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.425 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.886 HD21 ' HE2' ' A' ' 59' ' ' MET . 11.3 mt -61.5 -43.9 98.04 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.88 0.371 . . . . 0.0 110.06 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.787 ' HB1' ' CZ ' ' B' ' 73' ' ' PHE . . . -55.29 -34.22 63.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.324 0.583 . . . . 0.0 110.942 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.17 -17.01 10.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.195 -179.682 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.502 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.16 13.64 15.77 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.764 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.435 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.5 OUTLIER -157.32 -42.87 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.263 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 20.4 m-70 -75.86 147.67 38.9 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.378 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.35 78.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.477 ' CB ' ' CE2' ' B' ' 73' ' ' PHE . 74.9 m -145.99 -53.55 0.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.623 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.674 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -112.96 -44.97 3.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.743 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 85' ' ' VAL . 7.9 m -64.73 -27.23 42.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.317 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -96.29 24.66 5.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.09 27.04 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.282 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.705 ' HB1' ' CB ' ' A' ' 98' ' ' GLN . . . -137.43 60.83 28.52 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.286 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.458 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 41.7 Cg_exo -58.53 -46.74 22.34 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.699 2.266 . . . . 0.0 112.859 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 91.4 Cg_endo -80.93 -23.71 5.3 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.351 2.034 . . . . 0.0 112.633 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.705 ' CB ' ' HB1' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -54.55 105.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.07 -179.931 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -86.43 -176.34 5.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.953 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -87.6 130.46 34.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.824 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.836 0.35 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -99.87 110.78 60.31 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.881 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.03 -100.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.67 2.247 . . . . 0.0 112.319 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' THR . . . . . 0.629 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -175.16 144.97 0.76 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.16 179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.87 -40.29 6.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.081 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.95 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.6 m -70.07 -37.47 75.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.227 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.629 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.67 61.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.028 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -77.44 -26.81 51.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.635 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB3' HD22 ' A' ' 13' ' ' LEU . 81.7 m -72.34 -51.79 19.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.146 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ILE . . . . . 1.076 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -52.89 -56.26 8.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.653 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.3 OUTLIER -52.34 -27.55 15.85 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.4 OUTLIER -65.89 -55.66 15.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.027 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 13' ' ' LEU . . . . . 1.032 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -71.35 -27.65 63.51 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' ILE . . . . . 1.076 HD11 HG22 ' B' ' 10' ' ' ILE . 7.7 mt -67.31 -37.4 78.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.543 0.687 . . . . 0.0 110.851 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.11 -32.83 61.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.403 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 1.032 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.9 m -52.64 -38.31 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.505 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.5 t80 -77.48 -58.06 3.48 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.092 -1.413 . . . . 0.0 110.486 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 5.8 mm100 -49.07 -35.85 16.94 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -52.32 58.9 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.204 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' TYR . . . . . 0.884 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.8 m-85 -81.22 -47.38 13.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.768 0.794 . . . . 0.0 110.152 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.563 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.98 -20.92 26.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.897 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -70.15 165.09 51.64 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.327 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt 61.28 101.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -162.14 -46.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.872 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.94 -37.88 0.93 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -177.3 -39.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.831 0.348 . . . . 0.0 110.918 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.5 p -57.6 147.76 26.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.0 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -112.43 55.7 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.175 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.9 p -133.91 172.77 12.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.294 0.569 . . . . 0.0 110.798 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.884 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -114.41 -144.74 0.39 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.578 -179.878 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.541 ' H ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -160.65 138.01 9.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.615 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -41.6 44.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.809 0.337 . . . . 0.0 111.045 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 33' ' ' THR . . . . . 0.736 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.86 -45.25 62.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.855 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.41 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.6 mt-10 -57.61 -28.96 64.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.213 0.53 . . . . 0.0 109.952 179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' PHE . . . . . 0.456 ' CE2' ' CB ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -67.43 -33.01 74.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.83 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 36' ' ' LEU . . . . . 0.736 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.0 -59.21 4.41 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.437 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' SER . . . . . 0.593 ' O ' HG22 ' B' ' 41' ' ' THR . 68.9 m -54.2 -48.61 70.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.523 -178.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.516 ' HA ' HG22 ' B' ' 41' ' ' THR . 31.9 t80 -57.88 -27.42 63.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.858 0.361 . . . . 0.0 110.92 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' MET . . . . . 0.89 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -73.76 -58.19 3.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.209 -179.701 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 1.8 p30 -65.5 -19.32 65.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.051 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.943 HG23 ' HG2' ' B' ' 42' ' ' GLU . 13.3 t -95.98 -31.73 12.93 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' GLU . . . . . 0.943 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -129.25 14.54 6.16 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -177.775 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.776 HD12 ' CE ' ' B' ' 39' ' ' MET . 39.5 mt -161.87 41.47 0.14 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.575 ' HB1' ' HG3' ' B' ' 48' ' ' LYS . . . -75.64 -26.26 57.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.799 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.88 -7.6 36.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.036 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -112.28 -13.96 13.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.89 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.2 p -123.93 -17.52 6.26 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.575 ' HG3' ' HB1' ' B' ' 44' ' ' ALA . 24.8 mttm -47.24 126.52 9.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.943 0.401 . . . . 0.0 111.524 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 63.8 13.62 7.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.64 31.03 0.41 Allowed 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.772 0.32 . . . . 0.0 111.428 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -48.76 -29.36 4.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.941 0.401 . . . . 0.0 110.761 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.733 ' HB3' HG23 ' B' ' 55' ' ' VAL . 0.6 OUTLIER -130.0 88.31 49.02 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.513 179.571 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.45 -1.61 7.69 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.934 2.422 . . . . 0.0 113.021 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' GLY . . . . . 0.421 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -98.22 -2.24 58.0 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.893 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.777 HG12 HD22 ' B' ' 83' ' ' LEU . 32.0 t -84.44 -63.21 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.887 0.375 . . . . 0.0 111.332 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.629 HD12 ' SD ' ' B' ' 59' ' ' MET . 7.0 tp -75.36 -29.5 59.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.657 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 57' ' ' ASP . . . . . 0.571 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 19.4 t0 -76.05 -28.25 57.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.666 -178.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 7.2 mtt180 -75.23 -45.19 41.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.744 0.307 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 59' ' ' MET . . . . . 0.884 ' HE3' HD11 ' B' ' 83' ' ' LEU . 0.9 OUTLIER -54.28 -54.42 40.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.169 0.509 . . . . 0.0 112.112 -179.371 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 60' ' ' MET . . . . . 0.731 ' CE ' HD13 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -70.62 -22.73 62.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.548 -179.124 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 61' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -68.01 -60.93 2.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.916 0.388 . . . . 0.0 110.191 178.945 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.93 -14.26 62.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.933 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.992 HD22 ' CD2' ' B' ' 65' ' ' LEU . 4.8 tt -64.13 -8.67 12.95 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.792 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.439 ' CB ' ' O ' ' B' ' 63' ' ' LEU . 3.7 t70 82.37 -60.28 0.18 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.98 0.419 . . . . 0.0 110.19 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.992 ' CD2' HD22 ' B' ' 63' ' ' LEU . 1.1 mt 67.78 -159.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.978 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 66' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' B' ' 65' ' ' LEU . 64.0 m-20 64.87 150.22 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.86 0.362 . . . . 0.0 110.8 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 3.7 p -57.11 89.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.122 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -124.53 -44.26 1.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.64 37.22 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.499 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.42 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 3.6 mm100 57.38 -171.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.565 0.221 . . . . 0.0 110.786 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.8 OUTLIER -66.46 -146.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 72' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 1.3 p30 170.72 -169.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.227 0.536 . . . . 0.0 112.147 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.788 ' CB ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -70.15 -63.93 0.99 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.709 -178.785 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 74' ' ' GLN . . . . . 0.404 ' HA ' ' HB2' ' B' ' 77' ' ' LEU . 8.8 tp-100 -66.35 -34.07 77.15 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.561 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.924 ' O ' HD23 ' B' ' 79' ' ' LEU . 1.9 tt0 -45.06 -47.2 11.85 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.861 0.362 . . . . 0.0 110.095 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.9 t80 -71.01 -46.4 62.27 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.356 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' LEU . . . . . 0.707 HD13 ' HA3' ' A' ' 81' ' ' GLY . 7.1 mt -56.83 -40.14 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -76.39 -39.6 53.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.924 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -60.21 -58.23 9.39 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.559 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.654 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.2 -46.09 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.655 178.865 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.702 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -54.38 -50.13 57.68 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 178.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' GLY . . . . . 0.406 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.43 37.07 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.433 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.884 HD11 ' HE3' ' B' ' 59' ' ' MET . 11.3 mt -61.59 -43.94 97.92 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.878 0.371 . . . . 0.0 110.003 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.8 ' HB1' ' CZ ' ' A' ' 73' ' ' PHE . . . -55.12 -34.24 63.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.402 0.62 . . . . 0.0 110.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -84.32 -16.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.126 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 86' ' ' ALA . . . . . 0.509 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.1 13.59 15.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.775 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 87' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.5 OUTLIER -157.29 -42.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 88' ' ' HIS . . . . . 0.501 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 20.2 m-70 -75.96 147.78 38.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.96 0.41 . . . . 0.0 111.305 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.37 78.69 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' SER . . . . . 0.473 ' CB ' ' CE2' ' A' ' 73' ' ' PHE . 74.9 m -146.01 -53.57 0.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.534 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 91' ' ' PHE . . . . . 0.711 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -112.99 -44.93 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.702 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 92' ' ' VAL . . . . . 0.487 HG13 ' O ' ' B' ' 85' ' ' VAL . 8.1 m -64.75 -27.23 42.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -96.36 24.72 5.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.078 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.05 27.0 0.17 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.333 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.705 ' HB1' ' CB ' ' B' ' 98' ' ' GLN . . . -137.51 60.95 28.69 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.243 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 96' ' ' PRO . . . . . 0.458 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 41.7 Cg_exo -58.67 -46.66 22.41 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.619 2.213 . . . . 0.0 112.81 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 91.2 Cg_endo -80.96 -23.62 5.32 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.418 2.079 . . . . 0.0 112.607 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 98' ' ' GLN . . . . . 0.705 ' CB ' ' HB1' ' B' ' 95' ' ' ALA . 0.0 OUTLIER -54.64 105.46 0.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.019 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.3 mttm -86.37 -176.29 5.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.988 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 100' ' ' ARG . . . . . 0.411 ' HB3' ' CZ ' ' B' ' 100' ' ' ARG . 5.6 ptp180 -87.57 130.49 34.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.882 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.875 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.779 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.519 -0.238 0 CA-C-O 121.477 0.656 . . . . 0.0 111.485 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.75 -41.31 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.211 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.918 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -71.08 -39.41 72.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.227 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.779 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.2 mm-40 -51.92 -53.34 42.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.422 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -65.94 -26.64 67.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.184 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.552 ' SG ' HD22 ' B' ' 13' ' ' LEU . 0.3 OUTLIER -64.92 -49.86 68.75 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.353 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.051 HG22 HD11 ' A' ' 14' ' ' ILE . 2.8 mp -61.47 -57.16 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.744 0.307 . . . . 0.0 111.556 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.907 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -52.89 -27.42 18.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.754 -179.286 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.85 -55.44 22.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.702 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.3 mm? -74.22 -28.61 61.33 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -178.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.051 HD11 HG22 ' A' ' 10' ' ' ILE . 6.3 mt -66.88 -37.06 78.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.336 0.589 . . . . 0.0 111.398 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.93 49.06 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.692 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.3 m -52.24 -37.55 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' A' ' 16' ' ' VAL . 3.5 t80 -77.1 -57.95 3.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.277 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.823 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.3 mm-40 -48.98 -47.21 44.37 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.66 -51.8 20.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.69 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.5 m-85 -81.18 -29.76 34.55 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.617 0.722 . . . . 0.0 110.373 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.684 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -84.11 12.96 5.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.281 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.749 179.9 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 90' ' ' SER . 8.9 m . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.761 0.315 . . . . 0.0 111.375 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.684 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.2 p -129.86 -172.17 2.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 31' ' ' SER . 0.2 OUTLIER -142.71 -121.77 0.09 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.868 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.572 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -172.31 130.96 0.6 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.801 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.419 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 20.8 mtmt -50.02 -41.39 47.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 111.088 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -55.97 -28.79 58.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.106 0.479 . . . . 0.0 110.133 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -69.63 -31.98 70.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.104 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.704 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.6 mm? -53.12 -59.07 5.01 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.756 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 p -59.58 -41.8 91.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.645 -1.162 . . . . 0.0 111.866 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.662 ' HA ' HG22 ' A' ' 41' ' ' THR . 78.8 t80 -57.87 -46.97 84.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.87 0.367 . . . . 0.0 111.339 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.751 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -59.93 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.188 -179.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -73.3 -19.67 60.99 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.95 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.8 t -98.99 -31.07 11.99 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.95 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.3 mt-10 -132.39 23.82 4.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -177.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.912 HD21 HD11 ' B' ' 10' ' ' ILE . 11.8 mt -163.18 52.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.494 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.27 -27.31 59.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.475 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.65 -20.03 59.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 36.7 m-85 -97.61 -30.03 13.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.495 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.3 t . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 -179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 86' ' ' ALA . 32.7 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.3 -51.54 13.0 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.726 -179.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.844 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.0 t70 -55.28 -38.39 68.53 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.397 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.0 -32.89 61.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.689 0.28 . . . . 0.0 111.685 -179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.968 ' CE ' HD21 ' A' ' 83' ' ' LEU . 8.3 tmm? -73.95 -53.06 10.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.592 ' HG2' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.658 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.687 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.474 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.8 0.333 . . . . 0.0 111.483 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.464 ' HB2' ' H ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -62.29 -134.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.032 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 3.0 t0 178.58 -171.15 0.12 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 118.569 0.622 . . . . 0.0 111.623 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.814 ' CD2' HG21 ' B' ' 85' ' ' VAL . 41.3 p90 -83.31 -57.75 3.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.27 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 47.4 tp60 -76.1 -30.71 58.38 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.78 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.763 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -44.7 -42.32 7.51 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.427 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 1.7 t80 -70.01 -54.37 13.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.936 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.441 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.0 mt -53.58 -33.57 55.29 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.429 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.3 m-20 -74.68 -40.84 61.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.296 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.883 HD13 ' SD ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -65.05 -57.81 7.7 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.64 -42.51 48.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.045 179.125 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.86 -50.94 48.23 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.185 -1.007 . . . . 0.0 111.066 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.56 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.37 -41.82 63.51 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.365 -0.922 . . . . 0.0 111.843 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.968 HD21 ' CE ' ' A' ' 59' ' ' MET . 3.2 mt -61.21 -42.29 98.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -54.46 -33.19 59.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.428 0.632 . . . . 0.0 110.338 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.55 -17.77 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.466 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.518 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.59 13.68 20.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.19 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 10.9 t -154.58 -43.32 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.781 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -93.87 -164.73 1.21 Allowed 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.705 0.288 . . . . 0.0 110.917 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.421 ' O ' ' CB ' ' A' ' 90' ' ' SER . 8.5 mt-10 -58.34 -163.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.908 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.555 ' O ' HG12 ' B' ' 28' ' ' VAL . 0.4 OUTLIER 81.62 -57.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.026 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.13 -45.16 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.788 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.797 179.919 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.775 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.434 0.635 . . . . 0.0 111.538 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.67 -41.3 6.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.225 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.932 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -71.13 -39.39 72.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.233 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.775 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.95 -53.35 42.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.834 0.35 . . . . 0.0 110.369 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 53.1 mtm180 -65.88 -26.65 67.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.176 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.553 ' SG ' HD22 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -64.98 -49.84 68.7 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.316 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.104 HG22 HD11 ' B' ' 14' ' ' ILE . 2.8 mp -61.58 -57.07 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.702 0.287 . . . . 0.0 111.56 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.913 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -52.85 -27.5 18.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.728 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.81 -55.51 22.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.948 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.3 mm? -74.16 -28.63 61.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.104 HD11 HG22 ' B' ' 10' ' ' ILE . 6.3 mt -66.92 -37.0 78.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 O-C-N 121.722 -0.611 . . . . 0.0 111.428 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.37 -32.98 49.21 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.823 -1.081 . . . . 0.0 112.729 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.948 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.0 m -52.13 -37.62 22.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.464 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.5 t80 -77.03 -58.02 3.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.137 -1.392 . . . . 0.0 110.252 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.811 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.4 mm-40 -49.03 -47.2 44.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.58 -51.9 19.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.668 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.49 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.5 m-85 -81.1 -29.83 34.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.58 0.705 . . . . 0.0 110.45 178.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -84.03 12.97 5.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.628 -1.169 . . . . 0.0 112.346 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.734 179.835 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 90' ' ' SER . 8.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.751 0.31 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.2 p -129.84 -172.07 2.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.753 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 31' ' ' SER . 0.2 OUTLIER -142.83 -121.7 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.865 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.58 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -172.38 130.96 0.59 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.422 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 20.8 mtmt -49.96 -41.41 46.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.124 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.706 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.982 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.532 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.98 -28.75 58.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.071 0.462 . . . . 0.0 110.121 179.678 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.513 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -69.66 -32.06 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.055 178.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.6 mm? -53.08 -59.03 5.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.803 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' B' ' 41' ' ' THR . 3.1 p -59.63 -41.74 91.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.919 -178.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.646 ' HA ' HG22 ' B' ' 41' ' ' THR . 78.8 t80 -57.88 -46.98 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 111.311 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.75 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -59.91 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 -179.534 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -73.33 -19.7 60.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.448 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.99 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.9 t -98.98 -31.08 11.99 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.99 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.3 mt-10 -132.32 23.84 4.46 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.917 HD21 HD11 ' A' ' 10' ' ' ILE . 11.8 mt -163.18 52.93 0.17 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.002 0.429 . . . . 0.0 110.399 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.21 -27.33 59.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.485 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.62 -19.92 59.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.598 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 37.0 m-85 -97.74 -30.11 12.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.489 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.3 t . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.519 HG13 ' HB3' ' B' ' 86' ' ' ALA . 32.7 t . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 121.033 0.444 . . . . 0.0 111.47 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.847 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.32 -51.5 13.06 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.727 -179.259 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.847 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.0 t70 -55.36 -38.47 68.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.32 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -32.89 61.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.731 0.3 . . . . 0.0 111.666 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.967 ' CE ' HD21 ' B' ' 83' ' ' LEU . 8.3 tmm? -74.05 -52.95 11.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.592 ' HG2' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.739 -178.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.471 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.106 0 CA-C-O 120.804 0.335 . . . . 0.0 111.464 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.467 ' O ' HG22 ' B' ' 29' ' ' THR . 0.4 OUTLIER -62.36 -134.97 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.95 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 3.1 t0 178.64 -171.12 0.12 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.494 0.588 . . . . 0.0 111.532 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 41.6 p90 -83.2 -57.8 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.274 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.479 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 47.4 tp60 -76.1 -30.68 58.35 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.761 -179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.758 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -44.75 -42.34 7.63 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.513 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.7 t80 -70.0 -54.28 13.9 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.983 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.0 mt -53.58 -33.6 55.39 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.3 m-20 -74.76 -40.7 61.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.312 178.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.882 HD13 ' SD ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -65.06 -57.84 7.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.434 -179.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.73 -42.39 47.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.082 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.43 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.98 -50.89 49.18 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.06 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.34 -41.86 63.27 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.787 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.967 HD21 ' CE ' ' B' ' 59' ' ' MET . 3.2 mt -61.2 -42.23 98.23 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.921 0.391 . . . . 0.0 110.135 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.518 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -54.57 -33.13 59.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.414 0.626 . . . . 0.0 110.327 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.814 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.373 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.519 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -112.71 13.78 19.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.112 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.426 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 10.9 t -154.65 -43.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.841 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -94.09 -164.78 1.21 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.784 0.326 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' B' ' 90' ' ' SER . 8.7 mt-10 -58.34 -163.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.887 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.55 ' O ' HG12 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 81.61 -57.42 0.25 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.012 -179.799 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.11 -45.19 2.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.888 0.375 . . . . 0.0 110.829 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 179.92 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.307 0.575 . . . . 0.0 111.076 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.87 -44.58 9.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.322 -0.853 . . . . 0.0 111.056 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.981 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.2 -40.45 94.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.914 178.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -50.98 -36.05 37.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.575 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.73 -26.89 40.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.582 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.626 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.7 p -68.07 -41.95 81.15 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.639 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 3.4 mp -72.09 -54.51 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.53 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.956 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.66 -27.35 11.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.649 ' O ' HG13 ' A' ' 16' ' ' VAL . 52.2 m -77.59 -56.03 4.87 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.771 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.733 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -57.95 -27.85 63.78 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.968 0.413 . . . . 0.0 111.778 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 13.4 mt -71.81 -39.57 68.2 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-O 121.573 0.701 . . . . 0.0 110.512 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.612 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -77.47 -38.26 49.62 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.935 -1.484 . . . . 0.0 112.084 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.6 m -52.6 -33.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.47 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 1.6 t80 -80.51 -58.48 3.1 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.943 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.931 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.47 -27.53 64.3 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -50.28 72.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.202 0.525 . . . . 0.0 109.685 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.529 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 3.1 m-85 -79.44 -28.47 41.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.479 178.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.931 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -80.36 2.19 25.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.016 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.633 179.737 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.465 0.308 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.711 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p -139.29 -179.8 6.08 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.813 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.3 0.19 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.435 -179.698 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 28.8 t -173.63 126.71 0.4 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.121 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -49.82 -36.34 26.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.422 -179.126 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.09 -43.08 58.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.072 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.24 59.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 110.154 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.935 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -72.92 -29.45 63.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.908 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -59.13 -59.24 5.78 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.545 0.688 . . . . 0.0 111.507 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.425 ' O ' HG22 ' A' ' 41' ' ' THR . 33.7 t -68.03 -50.41 55.53 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.464 -178.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.529 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.8 m-85 -57.93 -25.89 61.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.228 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.607 ' HE2' HD13 ' A' ' 43' ' ' LEU . 1.5 ttm -78.17 -53.66 7.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.056 0.455 . . . . 0.0 110.531 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.69 30.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.095 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.937 HG23 ' HG2' ' A' ' 42' ' ' GLU . 9.2 t -96.87 -30.28 13.23 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.937 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -125.94 -42.18 1.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.664 HD21 HD11 ' B' ' 10' ' ' ILE . 7.4 mt -101.88 34.94 2.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.315 0.579 . . . . 0.0 110.162 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -81.16 -28.84 34.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.924 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.55 -25.54 17.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' ' CE1' ' A' ' 88' ' ' HIS . 4.5 m-85 -102.32 17.05 24.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.088 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.333 -0.137 0 CA-C-O 120.901 0.382 . . . . 0.0 110.992 -179.964 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 86' ' ' ALA . 61.7 t . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.56 -50.94 63.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.663 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -57.01 -26.69 60.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.064 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -50.05 75.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.827 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE2' HD21 ' A' ' 83' ' ' LEU . 1.3 ptp -56.36 -53.5 56.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.062 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.526 ' N ' ' CG ' ' A' ' 59' ' ' MET . 3.6 mmt . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.891 -179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.419 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.626 0.25 . . . . 0.0 110.846 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -63.27 -135.41 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER 172.79 -168.7 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.761 0.71 . . . . 0.0 111.753 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.7 ' CG ' HG11 ' B' ' 85' ' ' VAL . 31.8 p90 -76.21 -60.71 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.612 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.496 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.32 -25.61 39.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.438 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.7 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.4 OUTLIER -46.4 -31.77 2.84 Favored 'General case' 0 CA--C 1.522 -0.124 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.683 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.644 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.5 t80 -80.33 -54.35 5.8 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.856 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 77' ' ' LEU . 7.3 mt -55.95 -33.52 64.81 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.726 179.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.456 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.2 OUTLIER -75.85 -37.46 58.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.935 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.1 mp -66.08 -58.19 6.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.023 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.872 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.08 -44.77 49.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.562 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.474 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.82 -49.31 54.79 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.58 -43.59 53.2 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.363 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.4 mt -56.85 -44.84 82.53 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 110.018 178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.484 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.47 -41.62 73.21 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.186 0.517 . . . . 0.0 110.913 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.695 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -73.74 -17.11 17.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.285 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -109.11 16.37 22.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.565 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 44.8 t -158.38 -35.88 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -118.35 -67.87 0.96 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.693 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 2.1 mm-40 -36.55 156.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.128 0.49 . . . . 0.0 112.234 -178.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.19 66.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.146 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.41 -48.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.718 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.135 179.989 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.217 0 CA-C-O 121.363 0.601 . . . . 0.0 110.966 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.83 -44.66 9.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.998 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.21 -40.43 94.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.824 178.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.05 -36.14 38.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.47 -179.826 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.71 -26.82 40.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.636 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.631 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -67.93 -42.15 81.48 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.017 HG22 HD11 ' B' ' 14' ' ' ILE . 3.4 mp -71.93 -54.52 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.629 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.76 -27.23 11.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 52.2 m -77.69 -56.0 4.88 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.819 -0.352 . . . . 0.0 111.755 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.73 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.7 mm? -57.9 -27.8 63.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.991 0.424 . . . . 0.0 111.796 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.017 HD11 HG22 ' B' ' 10' ' ' ILE . 13.7 mt -71.96 -39.58 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 CA-C-O 121.481 0.658 . . . . 0.0 110.417 178.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . 0.615 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -77.42 -38.31 49.91 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.967 -1.47 . . . . 0.0 112.105 -176.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.73 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.3 m -52.56 -33.61 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.472 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 1.6 t80 -80.4 -58.66 3.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.436 -1.256 . . . . 0.0 112.897 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.926 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.38 -27.54 64.4 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -50.3 72.12 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.522 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 3.1 m-85 -79.35 -28.55 42.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.515 178.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.926 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -80.4 2.41 25.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.103 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.71 179.747 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.706 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p -139.33 -179.91 6.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.967 0.413 . . . . 0.0 110.773 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.685 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.21 0.19 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.504 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 28.7 t -173.7 126.56 0.39 Allowed 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.812 0.339 . . . . 0.0 110.092 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.435 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.4 OUTLIER -49.68 -36.43 25.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.459 -179.174 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.652 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.07 -43.06 59.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.061 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.504 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.25 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.98 0.419 . . . . 0.0 110.094 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.946 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -72.91 -29.43 63.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.941 179.073 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.652 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -59.19 -59.16 5.91 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.562 0.696 . . . . 0.0 111.565 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.429 ' O ' HG22 ' B' ' 41' ' ' THR . 33.6 t -67.95 -50.42 55.98 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.528 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.522 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.9 m-85 -57.99 -25.96 61.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.129 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.594 ' HE1' HD13 ' B' ' 43' ' ' LEU . 1.5 ttm -78.16 -53.61 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.047 0.451 . . . . 0.0 110.541 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.65 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.149 -179.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.958 HG23 ' HG2' ' B' ' 42' ' ' GLU . 9.2 t -96.83 -30.32 13.23 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.958 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.4 OUTLIER -125.9 -42.15 1.92 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.572 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.678 HD21 HD11 ' A' ' 10' ' ' ILE . 7.4 mt -101.89 34.99 2.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.291 0.567 . . . . 0.0 110.053 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -81.27 -28.77 34.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.903 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.62 -25.51 17.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.801 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.421 ' CZ ' ' CE1' ' B' ' 88' ' ' HIS . 4.5 m-85 -102.29 16.96 24.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.08 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t . . . . . 0 C--N 1.332 -0.156 0 CA-C-O 120.864 0.364 . . . . 0.0 111.003 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' B' ' 86' ' ' ALA . 62.0 t . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.804 0.335 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.51 -51.06 62.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -56.93 -26.76 60.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.063 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.52 -50.0 75.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.818 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 1.3 ptp -56.34 -53.53 56.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.086 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.529 ' N ' ' CG ' ' B' ' 59' ' ' MET . 3.6 mmt . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.879 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.428 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.517 0.199 . . . . 0.0 110.864 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -63.39 -135.42 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.484 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 0.8 OUTLIER 172.91 -168.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.819 0.736 . . . . 0.0 111.756 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.695 ' CG ' HG11 ' A' ' 85' ' ' VAL . 31.8 p90 -76.31 -60.62 2.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.568 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.507 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.38 -25.53 39.08 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.441 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.711 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.4 OUTLIER -46.46 -31.75 2.88 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.659 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.5 t80 -80.29 -54.45 5.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.805 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -55.93 -33.54 64.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.68 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.46 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.2 OUTLIER -75.82 -37.43 59.09 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.946 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.1 mp -66.06 -58.2 6.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.111 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.86 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.1 -44.77 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.54 179.047 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.481 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.8 -49.3 54.7 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 178.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.479 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.44 -43.62 52.34 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.44 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.4 mt -56.86 -44.85 82.58 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 110.025 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' GLU . . . -55.45 -41.66 73.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.205 0.526 . . . . 0.0 110.897 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.7 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -73.69 -17.27 17.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.209 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -108.95 16.37 22.7 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.54 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 44.6 t -158.38 -35.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -118.29 -67.79 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.696 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 2.1 mm-40 -36.52 156.47 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.14 66.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.159 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.49 -49.01 0.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.723 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.923 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.687 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.34 0.59 . . . . 0.0 111.254 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.91 -41.78 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.97 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.924 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -67.94 -38.75 83.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.048 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.687 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.4 -33.46 30.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.437 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -27.11 41.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.562 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.572 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.4 p -69.07 -45.16 71.03 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.087 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -65.98 -56.37 15.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.49 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.95 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.17 -27.27 13.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.674 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.542 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -69.84 -55.52 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.923 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.087 HD11 HG22 ' A' ' 10' ' ' ILE . 8.3 mt -69.47 -35.45 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-O 121.216 0.531 . . . . 0.0 110.778 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.37 51.21 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.538 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.923 HG22 ' O ' ' A' ' 13' ' ' LEU . 29.6 m -63.53 -37.11 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.167 0.508 . . . . 0.0 109.943 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.458 ' CE1' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.53 -60.1 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.847 -178.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.967 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -58.18 -26.66 63.04 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.36 -52.16 48.12 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.306 -0.557 . . . . 0.0 109.708 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.646 ' HB3' HD11 ' A' ' 30' ' ' LEU . 2.9 m-85 -80.53 -29.77 37.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.62 0.724 . . . . 0.0 109.235 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.967 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -83.3 20.08 1.38 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.523 -1.217 . . . . 0.0 112.218 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.501 179.931 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.886 0.374 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 5.9 p -146.11 158.76 43.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.09 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -117.39 -156.16 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.893 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.512 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -137.88 136.45 37.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 179.085 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' HD23 ' A' ' 36' ' ' LEU . 21.5 mtmt -49.86 -39.78 40.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.688 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.31 -44.58 51.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.28 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.436 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 1.3 tt0 -59.81 -29.14 68.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 0.0 109.941 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -75.59 -26.61 58.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.552 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.649 ' HB2' ' O ' ' A' ' 33' ' ' THR . 2.4 mm? -51.35 -59.26 4.42 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.686 0.755 . . . . 0.0 110.647 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.15 69.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.477 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 12.5 t80 -57.84 -28.98 64.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.402 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.459 ' CE ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -78.0 -35.94 49.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.055 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.769 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 59.7 m-80 -73.21 -19.78 61.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.212 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.78 -78.57 0.59 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.139 0.495 . . . . 0.0 111.606 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 1.9 mm-40 -51.36 -28.41 12.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.032 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.706 HD21 HD11 ' B' ' 10' ' ' ILE . 39.3 mt -134.57 51.48 2.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 110.478 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.769 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.75 -25.39 53.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.946 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.86 -14.52 63.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.134 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.42 -21.54 15.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.26 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.377 -179.625 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 86' ' ' ALA . 22.9 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.898 0.38 . . . . 0.0 111.386 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -51.1 70.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.756 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.82 -30.89 62.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.372 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -42.75 92.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.008 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.855 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -63.43 -53.54 50.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.339 -179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.523 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.298 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.695 0.283 . . . . 0.0 111.062 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.606 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -65.9 -136.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.501 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.03 -164.9 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.602 0.637 . . . . 0.0 111.603 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.916 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.3 p90 -81.71 -57.2 3.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.357 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.492 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 44.6 tp60 -80.35 -27.91 38.2 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.325 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -44.78 -36.59 3.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.649 ' CD2' HG23 ' A' ' 16' ' ' VAL . 2.0 t80 -80.38 -54.24 5.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.036 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.635 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.5 mt -50.12 -34.55 22.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.492 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.84 -38.46 53.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 75' ' ' GLU . 1.8 mp -63.82 -58.15 7.7 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.798 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.893 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.6 -42.37 63.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.174 178.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.92 51.81 Favored Glycine 0 CA--C 1.507 -0.446 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.598 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.54 -40.26 46.91 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.426 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.855 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.3 mt -60.26 -45.53 92.95 Favored 'General case' 0 C--O 1.23 0.056 0 O-C-N 122.571 -0.37 . . . . 0.0 110.327 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.44 -30.76 61.11 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.175 0.512 . . . . 0.0 110.843 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.91 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.99 -17.48 9.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.168 -179.657 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.718 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.31 12.83 17.7 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.199 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.14 -37.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.506 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.1 OUTLIER -89.37 -171.08 3.09 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.913 0.387 . . . . 0.0 111.3 -179.686 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.61 55.18 3.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.4 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.798 ' OG ' HG23 ' B' ' 14' ' ' ILE . 0.6 OUTLIER -117.57 -47.68 2.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.953 0.406 . . . . 0.0 110.412 179.377 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.755 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -135.37 -81.55 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.423 179.289 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 91' ' ' PHE . 7.2 m . . . . . 0 CA--C 1.531 0.239 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.672 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 121.342 0.592 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -41.76 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.953 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.903 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -68.0 -38.71 82.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.029 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.672 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.31 -33.56 29.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.469 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.59 -27.17 41.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.519 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.4 p -69.08 -45.1 71.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.211 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -66.09 -56.31 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.404 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.24 -27.21 13.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.679 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.3 OUTLIER -69.9 -55.56 9.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.32 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.907 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -68.51 -27.25 65.95 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.3 mt -69.42 -35.47 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-O 121.217 0.532 . . . . 0.0 110.832 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.38 51.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.408 -1.269 . . . . 0.0 112.613 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.907 HG22 ' O ' ' B' ' 13' ' ' LEU . 29.3 m -63.46 -37.2 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 109.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -80.48 -60.02 2.48 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.881 -178.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.915 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.1 OUTLIER -58.19 -26.75 63.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.28 -52.08 48.29 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.737 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.641 ' HB3' HD11 ' B' ' 30' ' ' LEU . 2.8 m-85 -80.64 -29.8 36.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.656 0.741 . . . . 0.0 109.215 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.915 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -83.3 20.13 1.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.172 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.533 179.885 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.456 -0.153 0 CA-C-O 120.969 0.414 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 5.8 p -146.19 158.75 43.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.034 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.762 HD12 ' CD2' ' B' ' 35' ' ' PHE . 0.0 OUTLIER -117.43 -156.14 0.62 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.88 179.598 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.511 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -137.89 136.41 37.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.947 0.403 . . . . 0.0 110.545 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.501 ' O ' HD23 ' B' ' 36' ' ' LEU . 21.5 mtmt -49.87 -39.75 40.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.673 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.646 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.29 -44.67 51.75 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.27 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.441 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 1.3 tt0 -59.88 -28.98 68.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.223 0.535 . . . . 0.0 109.987 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.762 ' CD2' HD12 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -75.6 -26.61 57.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.58 179.415 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' B' ' 33' ' ' THR . 2.4 mm? -51.49 -59.21 4.51 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.709 0.766 . . . . 0.0 110.571 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.17 69.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.422 -1.263 . . . . 0.0 110.407 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.466 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 12.6 t80 -57.92 -28.86 64.65 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.389 179.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.464 ' CE ' HD12 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -78.14 -35.84 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.942 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.768 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 59.8 m-80 -73.26 -19.79 60.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.178 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.81 -78.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 111.602 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.466 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 1.9 mm-40 -51.34 -28.39 12.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.082 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' A' ' 10' ' ' ILE . 38.7 mt -134.64 51.56 2.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.033 0.444 . . . . 0.0 110.482 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.768 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.83 -25.35 53.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.932 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.78 -14.52 63.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.174 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.45 -21.5 15.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.2 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.412 -179.645 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.717 HG22 ' O ' ' B' ' 86' ' ' ALA . 22.6 t . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.893 0.377 . . . . 0.0 111.391 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -50.97 70.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.85 -30.91 62.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.347 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -42.79 92.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.866 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.4 OUTLIER -63.48 -53.51 51.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.32 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.52 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.299 -179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.509 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 CA--C 1.523 -0.082 0 CA-C-O 120.766 0.317 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.609 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.4 OUTLIER -65.83 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 172.01 -164.89 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.574 0.625 . . . . 0.0 111.613 179.512 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.91 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.4 p90 -81.73 -57.16 3.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.384 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.488 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 44.7 tp60 -80.38 -27.8 38.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.348 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.811 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -44.94 -36.52 3.41 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CD2' HG23 ' B' ' 16' ' ' VAL . 2.0 t80 -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.077 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.5 mt -50.17 -34.53 22.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.488 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.86 -38.58 53.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.811 HD13 ' O ' ' B' ' 75' ' ' GLU . 1.8 mp -63.77 -58.24 7.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.713 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.905 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.66 -42.33 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.15 178.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.68 -50.04 50.83 Favored Glycine 0 CA--C 1.507 -0.461 0 N-CA-C 109.989 -1.245 . . . . 0.0 109.989 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.594 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.38 -40.39 45.95 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.403 -0.903 . . . . 0.0 111.446 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.866 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.1 mt -60.17 -45.63 92.45 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.332 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.585 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.36 -30.8 61.01 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.281 0.562 . . . . 0.0 110.891 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.916 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.04 -17.34 9.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.227 -179.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.717 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.35 12.79 17.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.194 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.16 -37.24 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.459 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.1 OUTLIER -89.3 -171.07 3.1 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.838 0.351 . . . . 0.0 111.356 -179.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.57 55.16 3.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.447 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.805 ' OG ' HG23 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -117.6 -47.59 2.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.406 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -135.43 -81.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.412 179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.571 HG22 ' O ' ' B' ' 91' ' ' PHE . 7.2 m . . . . . 0 CA--C 1.532 0.254 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.576 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 121.389 0.614 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.8 -49.23 10.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.442 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.812 HG23 ' CG1' ' B' ' 16' ' ' VAL . 3.9 m -64.12 -32.44 74.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.482 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.576 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.65 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.34 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' O ' ' OG ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -74.79 -26.86 60.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.372 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.566 ' HB3' HD22 ' B' ' 13' ' ' LEU . 73.7 m -68.14 -53.9 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.511 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.129 HG22 HD11 ' A' ' 14' ' ' ILE . 1.8 mp -50.77 -56.36 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.837 0.351 . . . . 0.0 111.355 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.822 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -53.88 -27.78 32.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.886 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -61.8 -55.61 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.268 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.047 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.75 55.93 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.129 HD11 HG22 ' A' ' 10' ' ' ILE . 5.3 mt -49.79 -29.29 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.103 0.478 . . . . 0.0 112.18 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.3 -31.75 21.43 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.842 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.047 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.6 m -53.32 -33.71 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.759 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.8 -56.44 4.13 Favored 'General case' 0 N--CA 1.46 0.06 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.79 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 8.6 mm-40 -48.54 -26.05 2.0 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.461 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.71 69.12 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.627 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -80.37 -50.4 10.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.947 0.879 . . . . 0.0 109.805 178.533 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.616 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -61.58 -52.14 65.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.929 -1.487 . . . . 0.0 112.167 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.457 179.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.76 HG12 ' O ' ' B' ' 90' ' ' SER . 29.6 m . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.785 0.326 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.616 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 p -149.22 -177.58 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.975 0.417 . . . . 0.0 111.15 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.627 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -141.55 -124.95 0.1 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.117 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.599 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -171.44 128.48 0.68 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.536 ' HG2' ' HE1' ' A' ' 60' ' ' MET . 19.6 mtmm -49.64 -41.17 41.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.858 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.643 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.65 -41.68 59.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.164 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.6 mt-10 -55.74 -28.84 57.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -26.91 59.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.236 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -61.19 -59.15 5.77 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.488 0.661 . . . . 0.0 111.672 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.8 p -64.6 -51.16 64.15 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.611 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.556 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.7 m-85 -58.05 -50.88 71.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.979 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.798 ' HG2' HG21 ' A' ' 47' ' ' THR . 3.3 ttm -58.62 -26.98 64.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.747 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 13.3 m-20 -73.25 -19.46 61.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.73 -79.96 0.59 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.511 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.66 -46.22 63.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.234 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.721 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -111.21 38.46 2.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.0 110.318 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.747 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.1 -30.32 58.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.774 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.28 -25.15 13.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.987 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.5 m-85 -109.39 23.65 14.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.011 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.798 HG21 ' HG2' ' A' ' 39' ' ' MET . 4.2 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-O 120.87 0.367 . . . . 0.0 110.972 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.458 HG12 HD22 ' A' ' 83' ' ' LEU . 95.7 t . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.694 0.283 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.856 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -67.37 -52.29 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.163 0.506 . . . . 0.0 110.663 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.856 ' N ' HD23 ' A' ' 56' ' ' LEU . 3.8 t0 -59.07 -26.8 64.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.678 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.85 -43.26 93.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.05 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.917 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -60.87 -53.29 59.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.892 0.377 . . . . 0.0 111.522 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.805 ' N ' ' HG2' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.031 -177.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.626 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.575 0.226 . . . . 0.0 111.021 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.702 HD12 ' HD1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -61.32 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 9.4 t70 166.72 159.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.941 0.791 . . . . 0.0 111.226 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.786 ' CG ' HG11 ' B' ' 85' ' ' VAL . 27.8 p90 -50.22 -58.65 5.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.519 -0.764 . . . . 0.0 113.004 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.5 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 37.0 tp60 -76.94 -29.29 55.57 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.278 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.736 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.97 -49.19 11.32 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.702 ' HD1' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -64.95 -54.91 23.12 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.621 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HG ' ' CZ ' ' A' ' 17' ' ' PHE . 5.7 mt -53.88 -33.98 58.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.2 0.524 . . . . 0.0 110.019 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.448 ' ND2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.15 -31.67 58.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.794 HD13 ' CG ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -70.36 -57.95 4.28 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.896 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.082 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.17 -42.8 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 CA-C-O 120.721 0.296 . . . . 0.0 110.434 178.424 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.74 -50.7 48.51 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.204 -0.998 . . . . 0.0 110.736 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -52.66 -36.7 49.28 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.768 178.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.917 HD21 ' HE3' ' A' ' 59' ' ' MET . 7.1 mt -63.64 -45.79 88.59 Favored 'General case' 0 CA--C 1.518 -0.27 0 O-C-N 122.692 -0.299 . . . . 0.0 110.452 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 88' ' ' HIS . . . -54.97 -32.02 61.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.32 0.581 . . . . 0.0 110.413 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.785 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.45 -17.58 9.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.347 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.84 13.66 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.379 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 1.7 t -154.4 -42.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 -179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.876 ' CD2' HD13 ' B' ' 14' ' ' ILE . 39.6 t60 -87.67 150.19 23.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.927 0.394 . . . . 0.0 110.712 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.69 110.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.215 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.757 ' O ' HG12 ' B' ' 28' ' ' VAL . 1.3 m -178.94 -62.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.7 m-85 -115.11 -32.85 5.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.157 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.593 -179.52 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.568 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.436 0.636 . . . . 0.0 110.974 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.79 -49.22 10.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.395 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.832 HG23 ' CG1' ' A' ' 16' ' ' VAL . 4.0 m -64.14 -32.51 74.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.414 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.568 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.57 61.53 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' B' ' 12' ' ' SER . 0.0 OUTLIER -74.78 -26.84 60.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.44 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.57 ' HB3' HD22 ' A' ' 13' ' ' LEU . 73.7 m -68.17 -53.9 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.508 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.082 HG12 HD11 ' A' ' 80' ' ' ILE . 1.8 mp -50.71 -56.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.889 0.376 . . . . 0.0 111.339 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.9 OUTLIER -53.91 -27.73 32.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.864 -179.338 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.452 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.9 OUTLIER -61.9 -55.59 28.12 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 1.052 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.77 55.86 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.047 HD11 HG22 ' B' ' 10' ' ' ILE . 5.2 mt -49.65 -29.4 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 CA-C-O 121.09 0.471 . . . . 0.0 112.162 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.2 -31.86 21.52 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.827 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 1.052 HG22 ' O ' ' B' ' 13' ' ' LEU . 15.6 m -53.23 -33.86 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 177.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.747 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.74 -56.48 4.11 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.809 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.855 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 8.7 mm-40 -48.49 -26.12 2.0 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.442 -179.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -50.72 69.21 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.623 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -80.35 -50.38 10.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.919 0.866 . . . . 0.0 109.859 178.481 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -61.6 -52.11 65.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.888 -1.506 . . . . 0.0 112.173 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.44 179.977 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.757 HG12 ' O ' ' A' ' 90' ' ' SER . 29.9 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.737 0.303 . . . . 0.0 111.285 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 8.1 p -149.2 -177.59 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.958 0.409 . . . . 0.0 111.119 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.623 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -141.49 -124.96 0.1 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.129 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.603 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -171.45 128.6 0.68 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.534 ' HG2' ' HE1' ' B' ' 60' ' ' MET . 19.6 mtmm -49.68 -41.18 42.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.64 -41.73 59.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.153 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.6 mt-10 -55.75 -28.8 57.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 0.0 110.376 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.36 -26.82 58.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.171 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.2 mm? -61.22 -59.16 5.75 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.568 0.699 . . . . 0.0 111.717 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 46.6 p -64.49 -51.15 64.43 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.694 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.555 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.8 m-85 -58.09 -50.87 71.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.99 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.771 ' HG2' HG21 ' B' ' 47' ' ' THR . 3.3 ttm -58.64 -27.06 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 110.5 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.74 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 13.6 m-20 -73.16 -19.39 61.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.77 -79.92 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.567 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.62 -46.33 63.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.13 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.719 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -111.2 38.49 2.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.272 0.558 . . . . 0.0 110.292 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.74 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.11 -30.27 58.18 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.826 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.29 -25.19 13.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.5 m-85 -109.44 23.76 14.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.006 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.771 HG21 ' HG2' ' B' ' 39' ' ' MET . 4.2 t . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.913 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.469 HG12 HD22 ' B' ' 83' ' ' LEU . 94.3 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.711 0.291 . . . . 0.0 111.286 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.849 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -67.35 -52.31 41.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.126 0.489 . . . . 0.0 110.654 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.849 ' N ' HD23 ' B' ' 56' ' ' LEU . 3.8 t0 -59.01 -26.95 64.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.667 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 8.4 mmt85 -64.7 -43.23 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.051 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.991 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -60.94 -53.35 58.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 111.455 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.795 ' N ' ' HG2' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.017 -177.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.618 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.54 0.21 . . . . 0.0 111.039 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.737 HD12 ' HD1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -61.28 -129.62 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 9.4 t70 166.76 159.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.785 ' CG ' HG11 ' A' ' 85' ' ' VAL . 27.5 p90 -50.2 -58.71 5.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.951 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.49 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 36.9 tp60 -76.95 -29.22 55.5 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.326 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.722 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.92 -49.2 11.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.737 ' HD1' HD12 ' B' ' 71' ' ' LEU . 0.1 OUTLIER -65.01 -54.85 23.86 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.616 179.281 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.485 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 5.6 mt -53.88 -34.0 58.15 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 110.031 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.452 ' ND2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -76.06 -31.71 58.94 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 177.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.8 HD13 ' CG ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -70.3 -57.92 4.33 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.977 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 1.006 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.18 -42.83 58.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 120.713 0.292 . . . . 0.0 110.38 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.63 49.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.167 -1.016 . . . . 0.0 110.758 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.481 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -52.73 -36.63 49.68 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.719 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.991 HD21 ' HE3' ' B' ' 59' ' ' MET . 7.1 mt -63.64 -45.9 88.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 O-C-N 122.698 -0.295 . . . . 0.0 110.449 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' B' ' 88' ' ' HIS . . . -54.97 -32.0 61.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.295 0.569 . . . . 0.0 110.429 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.786 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.63 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.443 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.81 13.67 17.24 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.307 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.433 ' N ' ' O ' ' B' ' 83' ' ' LEU . 1.7 t -154.4 -42.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.888 ' CD2' HD13 ' A' ' 14' ' ' ILE . 39.5 t60 -87.67 150.08 23.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.822 0.344 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.65 110.61 0.53 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.23 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.76 ' O ' HG12 ' A' ' 28' ' ' VAL . 1.3 m -178.94 -62.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.7 m-85 -115.15 -32.8 5.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.057 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.501 -179.427 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.677 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.394 0.616 . . . . 0.0 111.23 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.49 -42.0 6.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.43 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.979 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -72.17 -41.74 66.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 109.998 179.188 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.677 ' HB2' HG23 ' A' ' 4' ' ' THR . 4.5 mm-40 -51.97 -45.85 64.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.984 0.421 . . . . 0.0 109.92 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -73.58 -26.62 60.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.584 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -64.55 -41.15 96.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.527 -179.507 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.979 HD12 ' O ' ' A' ' 6' ' ' THR . 3.4 mp -73.8 -51.31 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.955 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -51.83 -27.29 12.03 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.641 0.238 . . . . 0.0 111.641 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.578 ' O ' HG13 ' A' ' 16' ' ' VAL . 1.4 t -76.67 -55.73 5.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.653 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.48 65.16 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.955 HD12 ' HA ' ' A' ' 11' ' ' GLU . 20.1 mt -69.96 -41.53 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.865 0 CA-C-O 121.766 0.793 . . . . 0.0 110.741 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.636 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -73.99 -37.82 64.31 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.512 -175.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.847 HG22 ' O ' ' A' ' 13' ' ' LEU . 21.1 m -52.51 -36.99 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 121.731 0.777 . . . . 0.0 109.072 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.501 ' N ' HG23 ' A' ' 16' ' ' VAL . 2.9 t80 -80.52 -57.06 3.76 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 114.418 -1.265 . . . . 0.0 113.221 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.887 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -70.55 -24.48 62.8 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -52.16 64.19 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.415 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.629 ' OH ' HG21 ' A' ' 41' ' ' THR . 4.6 m-85 -80.51 -38.45 29.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.763 0.792 . . . . 0.0 109.473 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.887 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.16 -26.62 64.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.746 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.426 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.519 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.879 0.371 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 18.1 p -155.33 -178.34 7.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -136.82 -123.86 0.14 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.101 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.57 ' N ' HD22 ' A' ' 30' ' ' LEU . 5.3 t -175.68 130.33 0.26 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.65 -41.41 42.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.011 0.434 . . . . 0.0 110.474 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 0.9 OUTLIER -61.95 -50.35 72.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.313 179.317 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.432 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -57.8 -37.13 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -73.4 -31.03 63.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.272 178.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.76 -59.36 5.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.454 0.645 . . . . 0.0 110.217 179.112 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.703 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -61.18 -26.94 68.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.672 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.513 ' CD2' ' CE1' ' A' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.59 85.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.746 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.47 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 1.1 mtp -69.11 -35.23 76.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.133 0.492 . . . . 0.0 110.354 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.5 -19.24 60.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.879 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.809 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.3 t -110.38 -37.27 5.56 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.809 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.7 mm-40 -128.16 -27.01 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -176.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.707 HD21 HD11 ' B' ' 10' ' ' ILE . 5.1 mt -112.07 44.29 1.43 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.526 0.679 . . . . 0.0 109.718 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -78.68 -25.63 44.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.906 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.38 -23.41 65.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.444 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.573 ' CD1' HD22 ' A' ' 43' ' ' LEU . 3.9 m-85 -86.11 -32.33 21.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.542 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.9 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.177 -179.747 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.757 HG22 ' HB1' ' A' ' 86' ' ' ALA . 68.0 t . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 121.027 0.442 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.01 -51.69 10.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.099 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.85 -35.76 75.42 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.77 -52.3 66.3 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.656 ' HE1' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -75.34 -54.17 7.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.573 ' HE3' ' HA ' ' A' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.641 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 . . . . . 0 C--O 1.231 0.117 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.723 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -62.42 -133.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.492 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 4.6 t0 177.19 -178.95 0.19 Allowed 'General case' 0 N--CA 1.461 0.1 0 O-C-N 121.811 -0.556 . . . . 0.0 110.985 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CD2' HG21 ' B' ' 85' ' ' VAL . 44.1 p90 -69.22 -55.89 9.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.328 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.566 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -80.5 -26.3 38.26 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.74 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.723 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -44.62 -35.94 2.83 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.274 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.525 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 2.1 t80 -77.87 -54.01 6.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.638 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.801 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.2 mt -57.85 -33.4 68.61 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.566 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.04 -49.23 18.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 1.058 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 5.6 mp -65.62 -61.5 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.863 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.57 ' CG1' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.86 -44.58 86.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.574 178.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.805 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -60.77 -50.24 69.7 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 178.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.565 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -58.86 -39.77 94.34 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.053 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 1.058 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.8 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 88' ' ' HIS . . . -58.79 -41.45 86.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.544 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.835 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -74.22 -17.29 16.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.321 -179.139 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.757 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -109.34 17.59 21.33 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.329 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.44 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.586 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.457 ' N ' ' O ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.71 2.53 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.465 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.661 ' HG2' HG23 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -178.86 -168.84 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 111.248 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.11 -27.39 57.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.661 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -53.96 52.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.757 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.248 -179.874 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.702 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.282 0 CA-C-O 121.43 0.633 . . . . 0.0 111.223 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.44 -42.03 6.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.339 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.972 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -72.1 -41.85 66.81 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.002 0.429 . . . . 0.0 109.989 179.197 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.702 ' HB2' HG23 ' B' ' 4' ' ' THR . 4.5 mm-40 -51.86 -45.82 64.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.021 0.439 . . . . 0.0 109.931 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -73.59 -26.67 60.92 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.611 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -64.58 -41.03 96.54 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.597 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 0.972 HD12 ' O ' ' B' ' 6' ' ' THR . 3.4 mp -73.92 -51.32 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.839 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 1.012 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -51.88 -27.17 11.91 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.579 ' O ' HG13 ' B' ' 16' ' ' VAL . 1.4 t -76.78 -55.75 5.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.523 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.822 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.44 65.13 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.012 HD12 ' HA ' ' B' ' 11' ' ' GLU . 20.2 mt -69.94 -41.48 79.49 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.876 0 CA-C-O 121.878 0.847 . . . . 0.0 110.838 178.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . 0.636 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -74.05 -37.82 64.16 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 113.513 -1.676 . . . . 0.0 112.523 -175.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.822 HG22 ' O ' ' B' ' 13' ' ' LEU . 21.0 m -52.44 -36.97 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-O 121.718 0.77 . . . . 0.0 109.092 177.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.488 ' N ' HG23 ' B' ' 16' ' ' VAL . 2.9 t80 -80.44 -57.24 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.462 -1.245 . . . . 0.0 113.232 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.903 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.8 OUTLIER -70.46 -24.49 62.89 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -177.456 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.17 64.2 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.378 -179.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.62 ' OH ' HG21 ' B' ' 41' ' ' THR . 4.6 m-85 -80.53 -38.44 29.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.796 0.808 . . . . 0.0 109.421 177.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.903 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.23 -26.57 65.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.746 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.565 -179.915 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.925 0.393 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.679 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 18.0 p -155.32 -178.37 7.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -136.78 -123.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.151 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.565 ' N ' HD22 ' B' ' 30' ' ' LEU . 5.3 t -175.66 130.28 0.26 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.675 0.274 . . . . 0.0 110.281 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -41.32 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 0.0 110.503 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 0.9 OUTLIER -62.07 -50.32 72.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.293 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 0.5 OUTLIER -57.85 -37.07 73.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.279 0.561 . . . . 0.0 109.6 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -73.38 -31.07 63.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.274 178.234 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.1 OUTLIER -58.79 -59.32 5.61 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.463 0.649 . . . . 0.0 110.226 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.694 ' O ' HG22 ' B' ' 41' ' ' THR . 0.3 OUTLIER -61.25 -26.9 68.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.659 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.503 ' CD2' ' CE1' ' B' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.53 85.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.748 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.556 ' HE3' ' HB3' ' B' ' 43' ' ' LEU . 1.1 mtp -69.2 -35.09 75.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.09 0.471 . . . . 0.0 110.369 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.56 -19.22 60.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.9 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.79 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.3 t -110.46 -37.19 5.56 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.79 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.7 mm-40 -128.21 -27.05 2.75 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.722 HD21 HD11 ' A' ' 10' ' ' ILE . 5.1 mt -111.97 44.2 1.44 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.415 0.626 . . . . 0.0 109.707 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -78.58 -25.68 45.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.948 -179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.34 -23.43 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.588 ' CD1' HD22 ' B' ' 43' ' ' LEU . 3.9 m-85 -86.05 -32.38 21.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.8 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.182 -179.807 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.761 HG22 ' HB1' ' B' ' 86' ' ' ALA . 67.3 t . . . . . 0 N--CA 1.455 -0.204 0 CA-C-O 120.976 0.417 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 5.5 tp -76.94 -51.84 10.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.093 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.74 -35.79 75.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.673 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -58.77 -52.36 66.04 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.661 ' HE1' ' O ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -75.33 -54.12 7.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.595 ' HE3' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.62 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 . . . . . 0 CA--C 1.528 0.113 0 CA-C-O 120.588 0.232 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.71 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -62.55 -133.86 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.465 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 4.5 t0 177.2 -179.0 0.19 Allowed 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.473 0.579 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.835 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.8 p90 -69.07 -56.01 9.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.384 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -80.45 -26.24 38.46 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.821 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.721 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.66 -35.92 2.85 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.342 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 2.1 t80 -77.8 -54.15 6.67 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.629 178.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.805 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.2 mt -57.72 -33.58 68.57 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -75.84 -49.34 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 1.068 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 5.6 mp -65.63 -61.43 2.09 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.872 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.564 HD11 ' CG1' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -57.87 -44.54 86.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.585 178.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.801 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -60.78 -50.35 68.58 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.569 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -58.79 -39.68 94.07 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.189 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 1.068 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.81 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' B' ' 88' ' ' HIS . . . -58.78 -41.44 86.66 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.64 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.837 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -74.16 -17.39 16.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.404 -179.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.761 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -109.25 17.67 21.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.458 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.45 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.526 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.496 ' N ' ' O ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.74 2.53 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.439 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.63 ' HG2' HG23 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -178.88 -168.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.322 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 8.4 t -76.12 -27.33 57.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.649 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -53.89 53.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.269 -179.96 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.231 0 CA-C-O 121.397 0.618 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.9 -47.64 11.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.528 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.91 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.6 m -66.79 -34.77 78.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.628 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.638 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.59 -39.19 57.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.704 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.11 -26.67 60.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.965 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.624 ' HB3' HD22 ' B' ' 13' ' ' LEU . 76.3 m -69.8 -52.65 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.034 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -58.26 -56.65 14.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.923 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.56 -27.07 15.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.518 -179.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -64.39 -55.88 18.05 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.907 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.959 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -74.25 -27.28 60.68 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.034 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -66.73 -35.95 76.05 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 O-C-N 121.73 -0.606 . . . . 0.0 110.824 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.86 61.17 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.25 -176.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.959 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -53.84 -36.18 29.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.471 0.653 . . . . 0.0 109.74 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.529 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -80.17 -60.04 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.725 -178.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.987 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -66.7 -28.64 68.6 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.11 -50.99 57.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.948 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -79.67 -31.84 41.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.583 0.706 . . . . 0.0 109.562 178.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -71.55 -6.99 44.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 114.737 -1.12 . . . . 0.0 112.003 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 C--N 1.331 0.254 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.501 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' A' ' 29' ' ' THR . 3.3 m . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 119.717 -0.182 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.655 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p 54.09 163.22 0.01 OUTLIER 'General case' 0 C--N 1.339 0.143 0 CA-C-O 121.26 0.553 . . . . 0.0 111.637 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -114.98 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.13 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.523 ' N ' HD22 ' A' ' 30' ' ' LEU . 14.0 t 175.33 130.03 0.03 OUTLIER 'General case' 0 C--O 1.231 0.113 0 O-C-N 122.21 -0.306 . . . . 0.0 110.387 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -32.38 32.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.987 0.422 . . . . 0.0 110.757 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.588 ' HA ' HD12 ' A' ' 36' ' ' LEU . 1.0 OUTLIER -68.15 -48.61 64.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.024 179.291 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -28.74 70.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -70.8 -33.36 70.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.6 178.498 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.77 -59.73 4.97 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.502 0.668 . . . . 0.0 111.137 179.881 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.0 m -59.54 -34.02 72.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.06 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CE1' ' CB ' ' A' ' 42' ' ' GLU . 72.8 t80 -60.07 -55.02 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.676 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -58.57 -28.93 66.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.81 -19.77 60.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.88 -80.95 0.63 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.461 ' CB ' ' CE1' ' A' ' 38' ' ' PHE . 2.3 mm-40 -55.59 -24.31 32.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.46 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.957 HD21 HD11 ' B' ' 10' ' ' ILE . 11.4 mt -135.04 48.76 2.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.024 0.44 . . . . 0.0 110.838 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.41 -28.15 62.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.325 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.85 -24.75 62.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.636 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.623 ' HD2' HD22 ' A' ' 43' ' ' LEU . 66.8 m-85 -102.26 26.9 7.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.567 HG21 ' HG2' ' A' ' 39' ' ' MET . 5.0 t . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.773 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.663 HG12 HD22 ' A' ' 83' ' ' LEU . 94.2 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.91 0.386 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.713 HD12 ' SD ' ' A' ' 39' ' ' MET . 5.5 tt -68.46 -52.62 30.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.433 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.442 ' N ' HD23 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -58.02 -33.4 68.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.212 -178.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -54.18 50.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.251 . . . . 0.0 111.56 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -76.48 -42.56 43.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.439 ' HG3' HD12 ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.455 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.437 ' HB3' ' CB ' ' A' ' 29' ' ' THR . 2.0 mm-40 . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.745 0.307 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.531 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.26 -130.22 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 119.119 -0.467 . . . . 0.0 109.888 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.531 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.5 t0 175.31 -173.98 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.324 0.965 . . . . 0.0 112.375 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.849 ' CD2' HG21 ' B' ' 85' ' ' VAL . 43.5 p90 -83.2 -57.16 3.38 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.071 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.466 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.76 48.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.422 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.862 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.61 -48.27 10.41 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.529 ' CB ' ' HB2' ' A' ' 17' ' ' PHE . 1.7 t80 -65.21 -52.95 51.49 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.298 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.425 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.1 mt -53.2 -38.96 63.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.145 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.407 ' CB ' HE21 ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.36 -36.61 58.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.063 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.862 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -61.5 -57.23 12.97 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.841 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.982 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.21 -44.8 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.802 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.468 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -52.75 -50.7 48.58 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -56.56 -31.26 60.07 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.225 -0.988 . . . . 0.0 111.525 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.834 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 16.6 mt -66.54 -44.77 81.49 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.73 -33.86 64.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.272 0.558 . . . . 0.0 110.776 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.855 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.96 9.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.736 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.62 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -115.13 14.31 16.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.189 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.63 -40.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.399 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.507 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.7 t-160 -93.4 177.99 5.86 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.876 0.37 . . . . 0.0 111.123 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.54 93.55 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.55 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 173.92 111.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.566 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.1 t80 68.69 -67.06 0.22 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.714 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.1 179.851 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.632 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 121.414 0.626 . . . . 0.0 110.855 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -47.6 11.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.606 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.6 m -66.72 -34.79 78.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.678 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.632 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.56 -39.23 57.4 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.69 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.03 -26.74 60.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.983 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.627 ' HB3' HD22 ' A' ' 13' ' ' LEU . 78.5 m -69.87 -52.59 23.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.175 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.062 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -58.27 -56.68 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.764 0.316 . . . . 0.0 111.414 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.927 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.55 -27.07 15.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.452 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -64.41 -55.93 17.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.957 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -74.11 -27.34 60.83 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.062 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -66.77 -35.97 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-O 121.387 0.613 . . . . 0.0 110.785 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.8 61.19 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.228 -1.351 . . . . 0.0 112.331 -176.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.957 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.0 m -53.88 -36.12 29.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.467 0.651 . . . . 0.0 109.714 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.528 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -80.19 -60.11 2.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.865 -1.062 . . . . 0.0 112.654 -178.668 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.992 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -66.74 -28.58 68.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.06 -50.93 57.72 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.48 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -79.74 -31.81 41.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 109.606 177.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.992 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -71.52 -6.98 44.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.009 -179.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.348 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.545 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' B' ' 29' ' ' THR . 3.4 m . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 119.705 -0.188 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.652 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p 53.93 163.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.126 0 CA-C-O 121.228 0.537 . . . . 0.0 111.676 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.61 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -115.04 0.31 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.108 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.527 ' N ' HD22 ' B' ' 30' ' ' LEU . 13.8 t 175.43 130.17 0.04 OUTLIER 'General case' 0 C--O 1.231 0.126 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.98 -32.33 33.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.762 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.595 ' HA ' HD12 ' B' ' 36' ' ' LEU . 1.0 OUTLIER -68.22 -48.58 64.76 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.952 179.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -28.65 70.02 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.522 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -70.84 -33.41 70.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.512 178.504 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.595 HD12 ' HA ' ' B' ' 33' ' ' THR . 0.2 OUTLIER -58.74 -59.72 4.96 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.431 0.634 . . . . 0.0 111.109 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -59.52 -34.03 72.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.086 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.446 ' CE1' ' CB ' ' B' ' 42' ' ' GLU . 73.1 t80 -60.09 -55.06 38.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.609 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.716 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.3 OUTLIER -58.61 -28.85 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.86 -19.72 60.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.821 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.95 -81.02 0.63 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.446 ' CB ' ' CE1' ' B' ' 38' ' ' PHE . 2.3 mm-40 -55.56 -24.24 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.496 -178.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.928 HD21 HD11 ' A' ' 10' ' ' ILE . 11.3 mt -135.11 48.79 2.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.794 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -27.99 62.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.367 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.7 62.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.722 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.609 ' HD2' HD22 ' B' ' 43' ' ' LEU . 67.0 m-85 -102.24 26.72 7.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.873 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.595 HG21 ' HG2' ' B' ' 39' ' ' MET . 5.0 t . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.768 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.648 HG12 HD22 ' B' ' 83' ' ' LEU . 94.6 t . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.94 0.4 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.716 HD12 ' SD ' ' B' ' 39' ' ' MET . 5.5 tt -68.59 -52.5 31.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.455 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.438 ' N ' HD23 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -58.09 -33.35 68.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.147 -178.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -54.22 49.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.644 0.259 . . . . 0.0 111.502 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -76.44 -42.63 43.35 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.431 ' HG3' HD12 ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.433 ' HB3' ' CB ' ' B' ' 29' ' ' THR . 2.0 mm-40 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.715 0.293 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.53 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -65.2 -130.26 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.53 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 1.5 t0 175.28 -174.06 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.232 0.924 . . . . 0.0 112.256 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.855 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.3 p90 -83.19 -57.07 3.43 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.095 -179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.456 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.8 48.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.444 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.859 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.63 -48.14 10.46 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.528 ' CB ' ' HB2' ' B' ' 17' ' ' PHE . 1.7 t80 -65.32 -52.86 51.21 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.32 178.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.1 mt -53.3 -38.93 63.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.964 0.411 . . . . 0.0 110.147 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -36.81 58.27 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.859 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -61.27 -57.35 12.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.891 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.1 -44.92 30.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 123.639 0.587 . . . . 0.0 110.76 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.487 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.66 -50.77 47.7 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.521 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -56.66 -31.17 60.26 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 120.197 -1.002 . . . . 0.0 111.505 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.833 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 16.8 mt -66.63 -44.73 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.65 -33.94 64.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.237 0.541 . . . . 0.0 110.787 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.849 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.95 9.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.793 -179.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.612 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -115.14 14.47 17.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.226 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.64 -40.5 0.05 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.443 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.8 t-160 -93.44 178.0 5.85 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 120.94 0.4 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.71 93.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.273 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.551 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 173.93 111.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.606 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.546 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.1 t80 68.67 -67.02 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.823 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.131 179.791 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.338 0.589 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.03 10.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.101 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.992 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.52 -41.59 92.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.07 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.13 -35.72 36.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.498 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.67 -27.13 40.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.75 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.603 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.5 p -70.45 -41.37 72.93 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.296 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' A' ' 14' ' ' ILE . 2.9 mp -69.3 -54.95 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.731 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.994 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -51.84 -27.22 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 6.1 m -75.25 -55.83 5.32 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.84 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' B' ' 13' ' ' LEU . 3.9 mm? -61.13 -27.34 68.32 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' A' ' 10' ' ' ILE . 9.3 mt -71.8 -37.4 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 CA-C-O 121.505 0.669 . . . . 0.0 110.332 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.54 64.03 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.875 -177.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.838 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.4 m -53.8 -35.7 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.48 0.657 . . . . 0.0 109.479 178.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.491 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -80.33 -59.74 2.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.582 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.942 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -69.91 -24.97 63.47 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -51.71 57.92 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.244 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.9 m-85 -80.19 -40.22 27.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.712 0.768 . . . . 0.0 109.41 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.942 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.85 -26.16 57.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.707 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.712 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 p . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 120.812 0.339 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.654 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.1 p -129.98 -176.87 4.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.753 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.657 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -137.81 -122.96 0.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.524 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.634 ' N ' HD22 ' A' ' 30' ' ' LEU . 18.5 t -179.82 127.9 0.09 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.406 ' O ' ' N ' ' A' ' 36' ' ' LEU . 0.0 OUTLIER -49.77 -40.69 42.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.18 -179.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.63 ' HA ' HD13 ' A' ' 36' ' ' LEU . 5.0 t -61.86 -43.51 98.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.459 ' N ' HG23 ' A' ' 33' ' ' THR . 15.7 mt-10 -61.52 -35.75 78.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.89 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -74.2 -29.9 61.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 176.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.84 -59.36 5.35 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.873 178.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -63.55 -41.19 98.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.489 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 t80 -60.02 -45.22 93.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.406 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.435 ' HE2' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -62.46 -31.28 71.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.788 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 18.7 m-80 -73.52 -19.74 60.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.39 -79.34 0.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.091 0.472 . . . . 0.0 111.862 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 2.7 mt-10 -52.07 -29.04 19.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.224 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' B' ' 10' ' ' ILE . 52.6 mt -130.41 50.14 2.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.099 0.476 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -79.2 -28.45 42.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.779 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.63 67.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.137 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.47 ' HD2' HD22 ' A' ' 43' ' ' LEU . 39.3 m-85 -102.06 27.2 6.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.962 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 65.0 p . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.202 -179.935 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 86' ' ' ALA . 39.0 t . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 59' ' ' MET . 7.7 tp -67.67 -51.16 53.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.96 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.84 -27.0 49.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -50.52 71.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.053 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.911 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.4 ptp -57.07 -53.52 57.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.277 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.503 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.364 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.605 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.779 0.323 . . . . 0.0 110.985 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.492 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -65.29 -131.38 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.932 179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.69 -168.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.879 0.763 . . . . 0.0 111.364 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.885 ' CG ' HG11 ' B' ' 85' ' ' VAL . 39.8 p90 -80.84 -60.51 2.28 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.894 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.483 HE22 ' HB2' ' A' ' 78' ' ' ASN . 0.3 OUTLIER -80.1 -22.19 42.46 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.225 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.781 ' O ' HD13 ' A' ' 79' ' ' LEU . 2.1 tt0 -47.17 -32.66 4.55 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.531 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.3 t80 -80.51 -54.31 5.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.722 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' B' ' 77' ' ' LEU . 5.8 mt -53.75 -33.97 57.48 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.483 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.43 -40.71 49.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 177.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.7 mp -62.39 -57.64 10.55 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.03 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.891 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -75.21 -45.27 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.121 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.559 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.44 -48.87 53.87 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.47 -41.44 48.84 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.255 -0.974 . . . . 0.0 111.318 178.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.911 HD21 ' HE2' ' A' ' 59' ' ' MET . 9.1 mt -56.72 -47.65 79.49 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 110.661 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.62 -32.61 63.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.184 0.516 . . . . 0.0 111.27 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.27 -17.57 9.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.607 -179.411 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.652 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -112.5 2.21 16.22 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.368 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.492 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -137.6 -41.48 0.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 -179.934 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' B' ' 14' ' ' ILE . 0.7 OUTLIER -82.09 -166.64 1.29 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.887 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.87 36.4 1.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.312 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.618 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -99.53 7.56 45.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.779 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 177.92 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.386 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 7.1 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.857 179.897 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.246 0.546 . . . . 0.0 111.242 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.06 10.61 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.074 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.995 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.44 -41.62 93.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.192 0.52 . . . . 0.0 110.108 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.14 -35.71 37.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.539 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -27.25 41.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.803 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.618 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.5 p -70.33 -41.42 73.24 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.322 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.06 HG22 HD11 ' B' ' 14' ' ' ILE . 2.9 mp -69.32 -54.99 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.707 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -51.75 -27.29 11.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.336 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.559 ' O ' HG13 ' B' ' 16' ' ' VAL . 6.2 m -75.25 -55.92 5.23 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.764 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' A' ' 13' ' ' LEU . 3.9 mm? -61.03 -27.29 68.22 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.06 HD11 HG22 ' B' ' 10' ' ' ILE . 9.3 mt -71.86 -37.42 61.63 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 121.478 0.656 . . . . 0.0 110.336 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 -39.57 64.12 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.917 -177.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.827 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.4 m -53.76 -35.7 27.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.487 0.661 . . . . 0.0 109.479 178.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.487 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -80.28 -59.78 2.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.617 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.94 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.6 OUTLIER -69.92 -24.92 63.45 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -178.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -51.79 57.14 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.258 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.528 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.9 m-85 -80.2 -40.1 27.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.68 0.752 . . . . 0.0 109.413 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.94 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -57.01 -26.09 59.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.675 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.718 -179.753 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.8 p . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.749 0.309 . . . . 0.0 111.443 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.664 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.1 p -130.05 -176.86 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -137.8 -122.92 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.539 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.635 ' N ' HD22 ' B' ' 30' ' ' LEU . 18.8 t -179.88 127.84 0.08 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' B' ' 36' ' ' LEU . 0.0 OUTLIER -49.58 -40.68 39.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.239 -179.149 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.626 ' HA ' HD13 ' B' ' 36' ' ' LEU . 5.0 t -61.99 -43.44 98.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.464 ' N ' HG23 ' B' ' 33' ' ' THR . 15.7 mt-10 -61.5 -35.65 78.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.896 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -74.32 -29.85 61.79 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 176.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.626 HD13 ' HA ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -57.81 -59.39 5.3 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.874 178.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.9 p -63.6 -41.16 98.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.411 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 9.0 t80 -60.08 -45.19 93.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.429 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.422 ' HE2' HD13 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -62.39 -31.39 72.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.824 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 18.9 m-80 -73.4 -19.72 60.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.242 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.45 -79.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.102 0.477 . . . . 0.0 111.777 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.7 mt-10 -52.02 -29.04 19.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.224 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.758 HD21 HD11 ' A' ' 10' ' ' ILE . 53.6 mt -130.33 50.09 2.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.039 0.447 . . . . 0.0 110.811 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -79.22 -28.41 42.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.01 -24.71 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.072 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.495 ' HD2' HD22 ' B' ' 43' ' ' LEU . 39.0 m-85 -102.08 27.26 6.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.96 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 65.4 p . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.177 -179.918 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 86' ' ' ALA . 39.0 t . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 121.019 0.438 . . . . 0.0 111.094 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.453 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -67.74 -51.09 53.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.997 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -55.83 -26.96 49.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.32 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -50.42 72.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.008 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.933 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.4 ptp -57.13 -53.48 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.293 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.506 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.399 -179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.605 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.264 0 CA-C-O 120.848 0.356 . . . . 0.0 110.913 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.497 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.3 OUTLIER -65.35 -131.4 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.931 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.446 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.2 OUTLIER 172.68 -168.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.939 0.791 . . . . 0.0 111.392 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CG ' HG11 ' A' ' 85' ' ' VAL . 39.9 p90 -80.92 -60.6 2.24 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.761 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -80.03 -22.25 42.6 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.21 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.1 tt0 -47.19 -32.66 4.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 178.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.2 t80 -80.48 -54.28 5.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.765 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' A' ' 77' ' ' LEU . 5.8 mt -53.79 -33.88 57.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.468 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -40.73 49.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.896 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.7 mp -62.24 -57.67 10.59 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.07 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.91 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -75.24 -45.32 41.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.073 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.567 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.5 -48.86 54.28 Favored Glycine 0 C--N 1.333 0.4 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.508 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.43 -41.36 48.38 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.359 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.933 HD21 ' HE2' ' B' ' 59' ' ' MET . 9.2 mt -56.93 -47.55 80.37 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 120.676 0.274 . . . . 0.0 110.623 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.47 -32.81 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.199 0.523 . . . . 0.0 111.254 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.885 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.51 9.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.592 -179.332 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.638 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -112.48 2.17 16.22 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.418 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -137.59 -41.49 0.55 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' A' ' 14' ' ' ILE . 0.7 OUTLIER -82.06 -166.65 1.29 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.815 0.34 . . . . 0.0 110.919 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.76 36.35 1.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.346 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.619 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.0 OUTLIER -99.56 7.53 45.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.051 179.744 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.793 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 177.88 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 7.4 t . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.799 179.895 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 121.544 0.688 . . . . 0.0 111.152 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.36 -48.98 13.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.417 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.952 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.3 m -64.34 -37.1 86.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.53 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.75 -38.25 54.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.727 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.87 -26.77 43.99 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.092 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HB3' HD22 ' B' ' 13' ' ' LEU . 63.9 m -69.23 -52.99 22.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.139 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -53.25 -56.15 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.541 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.44 -27.31 15.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.601 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -68.52 -55.9 10.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.96 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -68.68 -27.69 66.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -178.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.139 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -68.1 -36.34 75.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 O-C-N 121.666 -0.646 . . . . 0.0 110.508 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -32.65 41.89 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.482 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.2 m -51.73 -37.14 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.473 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.9 t80 -78.37 -58.54 3.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.319 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.788 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.5 mm-40 -49.13 -32.92 10.85 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.23 -51.96 67.59 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.876 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.1 m-85 -81.2 -47.69 13.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.778 0.799 . . . . 0.0 109.963 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.438 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -61.31 -17.03 51.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.887 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.39 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.491 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 28' ' ' VAL . 14.3 p . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.835 0.35 . . . . 0.0 111.38 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -143.38 150.84 39.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.144 0.497 . . . . 0.0 111.455 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -107.69 -152.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.961 179.264 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.451 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -148.52 147.62 29.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.207 0.527 . . . . 0.0 111.089 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -44.76 68.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.755 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.056 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -74.62 -36.4 62.93 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.33 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -55.06 -30.63 60.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.514 ' CE2' ' HB3' ' A' ' 79' ' ' LEU . 2.3 t80 -81.21 -47.55 13.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.272 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 1.056 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -63.46 -28.08 69.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.783 0.325 . . . . 0.0 110.39 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.57 -28.38 33.86 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 20' ' ' TYR . 3.4 t80 -59.06 -54.79 43.09 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.983 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.568 ' HE2' ' HB3' ' A' ' 43' ' ' LEU . 2.8 mtp -48.8 -30.11 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.521 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -73.59 -19.47 60.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.186 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -105.11 -50.8 3.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.309 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.569 ' O ' HG21 ' B' ' 4' ' ' THR . 1.1 mm-40 -128.31 -12.55 5.07 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -177.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.945 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -117.48 46.71 1.66 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.353 0.597 . . . . 0.0 110.296 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.11 -30.54 27.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.993 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.43 -26.02 28.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.823 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -97.23 22.72 8.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.56 HG21 ' HB3' ' A' ' 39' ' ' MET . 26.2 p . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.686 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 121.169 0.509 . . . . 0.0 110.53 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.48 ' N ' HG22 ' A' ' 55' ' ' VAL . 8.7 tp -68.99 -51.48 38.96 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.002 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.16 -28.72 69.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.212 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.61 73.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.821 0.344 . . . . 0.0 110.849 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE3' HD21 ' A' ' 83' ' ' LEU . 1.8 ptp -67.27 -53.44 29.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.138 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.736 ' HE2' ' HG3' ' A' ' 59' ' ' MET . 10.0 mmt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.31 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.542 HE21 ' HA ' ' A' ' 70' ' ' GLN . 2.2 mm-40 . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 120.389 0.138 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.661 HD11 HD22 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -54.2 -130.62 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.571 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.596 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 3.8 p30 162.4 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.841 ' CG ' HG11 ' B' ' 85' ' ' VAL . 41.6 p90 -83.39 -58.62 2.75 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.54 ' O ' ' N ' ' A' ' 78' ' ' ASN . 42.0 tp60 -80.33 -34.54 36.56 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' HG ' ' A' ' 71' ' ' LEU . 2.2 tt0 -44.49 -39.54 4.9 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.285 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.546 ' CD2' HD12 ' A' ' 30' ' ' LEU . 3.2 t80 -71.74 -52.86 15.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.749 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -55.62 -33.45 64.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -73.03 -40.3 65.25 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.667 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.8 mp -62.51 -57.13 12.26 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.543 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.074 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -70.45 -42.74 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 CA-C-O 120.828 0.347 . . . . 0.0 110.507 178.567 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.67 -50.58 48.57 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.413 -0.899 . . . . 0.0 110.895 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.74 -41.0 49.89 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.352 -0.927 . . . . 0.0 111.721 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE3' ' A' ' 59' ' ' MET . 4.0 mt -60.17 -46.79 88.51 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 122.634 -0.333 . . . . 0.0 110.787 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.13 58.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.093 0.473 . . . . 0.0 111.296 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.834 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.61 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.114 -178.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -117.66 8.46 12.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.963 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.82 -37.78 0.4 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.663 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.602 ' CD2' HD13 ' B' ' 14' ' ' ILE . 1.6 t60 -103.49 166.68 10.28 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.883 0.373 . . . . 0.0 111.06 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -59.75 115.7 3.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.64 -68.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.681 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.741 ' HB2' HG12 ' A' ' 85' ' ' VAL . 4.5 t80 -114.67 -32.56 5.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.749 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.472 -179.529 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.681 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.23 0 CA-C-O 121.51 0.671 . . . . 0.0 111.229 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.3 -49.08 12.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.323 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.961 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.4 m -64.32 -37.04 86.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.51 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.681 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -38.19 54.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.768 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.91 -26.82 43.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.061 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB3' HD22 ' A' ' 13' ' ' LEU . 63.9 m -69.21 -52.93 22.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.244 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.11 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -53.19 -56.18 9.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.639 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.948 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.28 -27.52 15.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.614 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -68.5 -55.86 10.32 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.697 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.958 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -68.67 -27.76 66.27 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.11 HD11 HG22 ' B' ' 10' ' ' ILE . 7.6 mt -68.08 -36.4 75.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 O-C-N 121.724 -0.61 . . . . 0.0 110.446 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.58 -32.56 42.0 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.545 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.958 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.9 m -51.77 -37.12 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.467 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.8 t80 -78.39 -58.62 3.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.3 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.5 mm-40 -49.06 -32.94 10.48 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.16 -51.93 67.66 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.959 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.667 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.1 m-85 -81.17 -47.74 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.782 0.801 . . . . 0.0 109.952 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.422 ' HB2' ' CE1' ' B' ' 17' ' ' PHE . . . -61.43 -16.92 51.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.926 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.421 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.603 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 28' ' ' VAL . 14.2 p . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.878 0.371 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -143.39 150.83 39.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.211 0.529 . . . . 0.0 111.508 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.667 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -107.71 -152.33 0.48 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.91 179.361 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.45 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -148.49 147.51 29.19 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.128 0.489 . . . . 0.0 111.115 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -44.81 68.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.751 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 1.004 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -74.61 -36.41 62.95 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.295 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.421 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -55.16 -30.59 60.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.521 ' CE2' ' HB3' ' B' ' 79' ' ' LEU . 2.3 t80 -81.28 -47.52 13.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.246 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 1.004 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.6 OUTLIER -63.42 -28.03 69.7 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 120.872 0.367 . . . . 0.0 110.509 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.55 -28.42 33.91 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.222 0.534 . . . . 0.0 109.641 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.498 ' CD2' ' CD1' ' B' ' 20' ' ' TYR . 3.4 t80 -58.95 -54.79 43.17 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.01 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.571 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 2.7 mtp -48.89 -30.17 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -73.55 -19.51 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' B' ' 38' ' ' PHE . 0.7 OUTLIER -105.08 -50.74 3.17 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -178.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.581 ' O ' HG21 ' A' ' 4' ' ' THR . 1.1 mm-40 -128.42 -12.5 5.01 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.991 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -117.63 46.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.294 0.568 . . . . 0.0 110.218 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.19 -30.53 27.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.989 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.39 -26.03 27.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -97.28 22.87 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.852 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.548 HG21 ' HB3' ' B' ' 39' ' ' MET . 26.6 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.178 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.703 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 121.136 0.493 . . . . 0.0 110.489 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.478 ' N ' HG22 ' B' ' 55' ' ' VAL . 8.7 tp -69.05 -51.47 38.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.96 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.14 -28.69 69.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -35.57 73.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 1.072 ' HE3' HD21 ' B' ' 83' ' ' LEU . 1.8 ptp -67.23 -53.41 30.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.723 ' HE2' ' HG3' ' B' ' 59' ' ' MET . 10.0 mmt . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.247 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.546 ' HA ' HE21 ' B' ' 70' ' ' GLN . 2.2 mm-40 . . . . . 0 CA--C 1.521 -0.144 0 CA-C-O 120.391 0.139 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.664 HD11 HD22 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -54.3 -130.64 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.593 -179.685 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.598 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 3.7 p30 162.53 -148.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.834 ' CG ' HG11 ' A' ' 85' ' ' VAL . 41.7 p90 -83.38 -58.57 2.77 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.586 ' O ' ' N ' ' B' ' 78' ' ' ASN . 42.1 tp60 -80.31 -34.59 36.65 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.615 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.2 tt0 -44.63 -39.39 4.99 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.296 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD2' HD12 ' B' ' 30' ' ' LEU . 3.2 t80 -71.72 -52.9 15.4 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.4 mt -55.56 -33.51 63.93 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -72.96 -40.35 65.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.681 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.8 mp -62.47 -57.22 12.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.472 179.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.989 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -70.43 -42.75 78.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.769 0.319 . . . . 0.0 110.497 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.67 -50.64 48.3 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.572 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.79 -40.95 50.17 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.37 -0.919 . . . . 0.0 111.725 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 1.072 HD21 ' HE3' ' B' ' 59' ' ' MET . 4.0 mt -60.09 -46.87 88.14 Favored 'General case' 0 C--N 1.332 -0.171 0 O-C-N 122.624 -0.339 . . . . 0.0 110.813 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.51 -29.1 58.25 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.089 0.471 . . . . 0.0 111.348 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.841 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.62 9.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.04 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -117.66 8.45 12.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.978 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.81 -37.81 0.4 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.655 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.61 ' CD2' HD13 ' A' ' 14' ' ' ILE . 1.6 t60 -103.5 166.61 10.32 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.922 0.391 . . . . 0.0 111.052 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.64 115.71 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.69 -68.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.703 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 4.5 t80 -114.58 -32.49 5.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.77 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.505 -179.523 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.596 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.359 0.6 . . . . 0.0 111.106 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -44.84 -49.31 10.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.621 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.868 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.3 OUTLIER -62.53 -39.11 92.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.122 0.487 . . . . 0.0 109.894 178.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.596 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.63 -30.25 20.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.293 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -27.91 41.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.777 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 5.5 p -75.3 -41.79 56.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.261 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.026 HG22 HD11 ' A' ' 14' ' ' ILE . 1.9 mp -68.26 -53.81 26.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.869 0.366 . . . . 0.0 111.301 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.897 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -51.88 -27.29 12.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.101 -178.651 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' VAL . 9.1 m -73.65 -56.05 5.5 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.916 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.6 mm? -63.43 -28.76 70.19 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.026 HD11 HG22 ' A' ' 10' ' ' ILE . 14.4 mt -68.97 -38.53 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.881 0 CA-C-O 121.593 0.711 . . . . 0.0 110.894 179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.66 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -78.46 -31.38 47.89 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.786 -175.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.916 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.9 m -54.34 -40.77 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.624 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -81.71 -55.48 4.61 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -178.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.966 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -62.9 -24.76 67.99 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.733 -177.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -51.38 62.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 9.8 m-85 -81.38 -29.01 34.13 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.815 176.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.966 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -85.88 20.25 2.28 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.121 -178.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.495 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.624 ' O ' HG13 ' A' ' 28' ' ' VAL . 7.1 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.904 0.383 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.2 p -154.25 160.99 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.196 0.522 . . . . 0.0 111.158 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.782 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -114.8 -116.73 0.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.009 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' A' ' 30' ' ' LEU . 23.1 t 179.98 130.16 0.09 Allowed 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.41 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 8.5 ttpt -49.73 -36.34 25.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.919 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.762 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -73.99 -45.25 51.09 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 4.2 mt-10 -55.92 -29.05 59.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.972 0.415 . . . . 0.0 110.276 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.23 -26.96 63.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.913 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.28 -58.87 5.92 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.663 0.744 . . . . 0.0 110.852 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.605 ' O ' HG22 ' A' ' 41' ' ' THR . 6.3 m -55.52 -44.95 77.15 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.815 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB ' ' A' ' 16' ' ' VAL . 50.8 t80 -57.86 -27.21 63.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.044 0.45 . . . . 0.0 110.449 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.729 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -74.15 -64.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.69 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.624 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 66.7 m-80 -56.61 -19.44 16.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.032 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 1.048 HG23 ' HG2' ' A' ' 42' ' ' GLU . 12.2 t -98.52 -26.48 14.41 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 1.048 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -129.9 -41.15 1.32 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.634 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' A' ' 39' ' ' MET . 14.0 mt -115.31 48.03 1.23 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.267 0.556 . . . . 0.0 110.046 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.624 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -84.5 -35.68 22.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.327 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.4 -22.72 8.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.878 0.371 . . . . 0.0 110.925 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 2.3 m-85 -88.98 -29.06 19.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.798 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.729 HG21 ' HG2' ' A' ' 39' ' ' MET . 2.1 t . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.849 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.463 0.191 0 CA-C-O 120.987 0.422 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.706 HD13 ' N ' ' A' ' 57' ' ' ASP . 0.5 OUTLIER -59.72 -51.46 69.69 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.703 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.706 ' N ' HD13 ' A' ' 56' ' ' LEU . 35.9 t70 -67.81 -26.01 65.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.666 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.02 -33.61 69.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 0.0 110.567 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.868 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -75.11 -54.3 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.648 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.709 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 1.9 mtm . . . . . 0 C--N 1.326 -0.441 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.774 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.428 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 2.2 mm-40 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.75 0.309 . . . . 0.0 111.052 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.933 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.8 -133.53 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.725 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 20.7 t70 160.37 165.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 118.895 0.77 . . . . 0.0 111.121 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.632 ' CG ' HG11 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -46.46 -56.45 5.92 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.265 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.57 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 23.9 tp60 -79.01 -33.25 45.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.521 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.933 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -44.79 -31.98 1.39 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HD1' HD12 ' A' ' 71' ' ' LEU . 1.5 m-85 -80.51 -54.76 5.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.708 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -61.69 -33.71 74.48 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.688 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.87 -36.62 70.15 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.3 mp -65.74 -57.75 7.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.764 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.978 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.65 -41.99 48.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.493 179.197 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.75 -49.99 51.52 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.77 -37.09 42.4 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 111.614 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.856 HD21 ' HE2' ' A' ' 59' ' ' MET . 5.4 mt -62.57 -47.49 83.62 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.807 0.337 . . . . 0.0 110.36 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.544 ' HB2' ' CG2' ' B' ' 10' ' ' ILE . . . -55.61 -30.8 61.53 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.361 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.627 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.19 -17.34 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.787 -178.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.687 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -115.44 7.69 15.08 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.622 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.442 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -145.8 -42.79 0.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.436 ' CD2' HG21 ' B' ' 10' ' ' ILE . 12.7 m-70 -85.83 176.44 8.1 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.51 2.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.494 ' O ' HG21 ' B' ' 28' ' ' VAL . 0.1 OUTLIER -170.54 -56.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.823 -179.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.427 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -125.33 -44.49 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.295 -179.954 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.592 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.185 0 CA-C-O 121.404 0.621 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -44.9 -49.26 11.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.629 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.876 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.4 OUTLIER -62.62 -39.01 92.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.095 0.474 . . . . 0.0 109.889 179.027 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.592 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.74 -30.26 21.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.282 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.54 -27.8 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.8 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB2' HD22 ' A' ' 13' ' ' LEU . 5.6 p -75.3 -41.84 56.05 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.26 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.012 HG22 HD11 ' B' ' 14' ' ' ILE . 1.9 mp -68.24 -53.76 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.4 . . . . 0.0 111.354 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.914 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.5 OUTLIER -51.91 -27.27 12.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.075 -178.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.629 ' O ' HG13 ' B' ' 16' ' ' VAL . 8.9 m -73.71 -56.04 5.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.6 mm? -63.48 -28.67 70.12 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.012 HD11 HG22 ' B' ' 10' ' ' ILE . 14.5 mt -69.04 -38.38 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.884 0 CA-C-O 121.508 0.671 . . . . 0.0 110.881 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . 0.668 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -78.59 -31.34 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.113 -1.403 . . . . 0.0 112.744 -175.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.902 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.0 m -54.38 -40.77 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -81.72 -55.41 4.65 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -178.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.939 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -62.86 -24.82 67.99 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.69 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.33 -51.37 62.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.503 ' HB3' HD21 ' B' ' 30' ' ' LEU . 9.7 m-85 -81.38 -28.97 34.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.835 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.939 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -85.89 20.29 2.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.116 -178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.55 179.883 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.629 ' O ' HG13 ' B' ' 28' ' ' VAL . 7.1 p . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.946 0.403 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 9.3 p -154.25 160.96 42.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.261 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.76 ' HB2' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -114.84 -116.75 0.32 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.997 179.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' B' ' 30' ' ' LEU . 23.1 t -179.99 130.24 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.421 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 8.5 ttpt -49.83 -36.27 26.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.891 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.764 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.08 -45.26 50.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.481 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 4.2 mt-10 -55.9 -28.99 59.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.352 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.19 -27.04 63.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.881 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.764 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.27 -58.92 5.73 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.616 0.722 . . . . 0.0 110.825 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.607 ' O ' HG22 ' B' ' 41' ' ' THR . 6.2 m -55.49 -44.86 76.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.878 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.467 ' HA ' HG22 ' B' ' 41' ' ' THR . 50.6 t80 -58.01 -27.13 63.25 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.464 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.731 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -74.19 -64.48 1.01 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.762 179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.625 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 66.8 m-80 -56.57 -19.66 16.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.983 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 1.049 HG23 ' HG2' ' B' ' 42' ' ' GLU . 12.1 t -98.4 -26.36 14.5 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 1.049 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.2 OUTLIER -129.92 -41.19 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' B' ' 39' ' ' MET . 13.9 mt -115.35 48.07 1.23 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -84.58 -35.59 22.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.389 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.67 8.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.949 0.404 . . . . 0.0 111.008 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 2.4 m-85 -89.01 -29.0 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.782 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.731 HG21 ' HG2' ' B' ' 39' ' ' MET . 2.1 t . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m . . . . . 0 N--CA 1.462 0.138 0 CA-C-O 121.045 0.45 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.695 HD13 ' N ' ' B' ' 57' ' ' ASP . 0.5 OUTLIER -59.74 -51.38 70.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.755 -179.535 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.695 ' N ' HD13 ' B' ' 56' ' ' LEU . 35.9 t70 -67.88 -26.08 65.83 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.575 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -33.66 69.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.848 0.356 . . . . 0.0 110.607 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.895 ' HE2' HD21 ' B' ' 83' ' ' LEU . 0.3 OUTLIER -75.18 -54.26 7.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.581 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.589 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 1.9 mtm . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.438 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 2.1 mm-40 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.731 0.301 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.91 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.76 -133.48 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.728 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 20.7 t70 160.36 165.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 118.93 0.786 . . . . 0.0 111.079 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.627 ' CG ' HG11 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -46.43 -56.4 5.97 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.303 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.562 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 23.6 tp60 -79.07 -33.25 44.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.489 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.91 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.3 OUTLIER -44.8 -31.97 1.4 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.872 0.368 . . . . 0.0 110.317 179.361 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.649 ' HD1' HD12 ' B' ' 71' ' ' LEU . 1.5 m-85 -80.49 -54.62 5.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.787 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -61.72 -33.76 74.6 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.716 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.401 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -71.86 -36.7 70.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.862 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.3 mp -65.67 -57.7 7.45 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.74 -41.85 47.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.781 0.324 . . . . 0.0 110.496 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -49.95 52.3 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.439 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.74 -37.08 42.1 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.64 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.895 HD21 ' HE2' ' B' ' 59' ' ' MET . 5.4 mt -62.69 -47.43 83.68 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.548 ' HB2' ' CG2' ' A' ' 10' ' ' ILE . . . -55.62 -30.7 61.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.172 0.511 . . . . 0.0 111.461 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.632 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.37 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.785 -179.02 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.675 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -115.49 7.71 15.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.533 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.444 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -145.72 -42.78 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.009 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.8 m-70 -85.9 176.41 8.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.42 2.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.507 ' O ' HG21 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -170.45 -56.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.871 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.436 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -125.37 -44.45 1.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.878 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.673 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 121.394 0.616 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -44.04 9.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.348 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.849 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -68.67 -38.15 80.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.275 179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.673 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.2 OUTLIER -52.04 -37.13 52.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.68 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.38 -26.77 41.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.816 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.473 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.34 66.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.392 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.088 HG22 HD11 ' A' ' 14' ' ' ILE . 2.1 mp -61.01 -57.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.69 0.281 . . . . 0.0 111.066 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.906 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -53.84 -27.57 30.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.183 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.56 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -62.7 -55.5 26.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.781 -179.54 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.018 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -71.35 -41.76 69.36 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.088 HD11 HG22 ' A' ' 10' ' ' ILE . 5.0 mt -56.11 -29.33 26.97 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 CA-C-O 121.083 0.468 . . . . 0.0 112.128 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.14 -32.89 21.06 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.526 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.018 HG22 ' O ' ' A' ' 13' ' ' LEU . 14.2 m -54.7 -31.4 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.749 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.34 -58.09 3.3 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.335 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.9 mm-40 -48.5 -30.86 5.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.6 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -61.96 -51.36 68.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.866 0.365 . . . . 0.0 110.505 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.682 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -80.42 -32.95 37.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.748 0.785 . . . . 0.0 109.563 178.312 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.587 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . . . -90.4 19.9 4.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.854 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.399 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 p . . . . . 0 CA--C 1.527 0.096 0 CA-C-O 120.685 0.279 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.26 -176.51 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.193 0.521 . . . . 0.0 111.357 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -135.38 -129.07 0.15 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.177 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.673 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -173.86 131.06 0.41 Allowed 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.53 -42.58 44.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 0.0 110.619 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 1.058 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -75.2 -43.12 53.75 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.192 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.518 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.1 mt-10 -55.28 -28.87 56.39 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.402 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.7 19.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.091 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 1.058 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.7 62.12 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.089 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -81.4 -53.81 5.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.272 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -62.31 -36.02 80.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.296 179.494 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.577 ' HE2' HD13 ' A' ' 43' ' ' LEU . 4.2 ttm -46.67 -36.94 7.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.128 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.665 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 23.2 m-80 -64.0 -19.33 65.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.186 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.962 HG23 ' HG2' ' A' ' 42' ' ' GLU . 4.6 t -84.12 -30.71 25.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.962 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.0 OUTLIER -135.35 -38.01 0.76 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.191 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.83 HD21 HD11 ' B' ' 10' ' ' ILE . 19.0 mt -104.65 36.09 2.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.39 0.614 . . . . 0.0 110.146 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -79.4 -38.24 35.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.11 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.75 -24.23 14.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.821 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.468 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 3.1 m-85 -100.27 27.11 5.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.784 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.5 p . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.059 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.523 HG22 ' HB1' ' A' ' 86' ' ' ALA . 85.6 t . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.661 0.267 . . . . 0.0 111.285 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.756 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -69.39 -51.61 34.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.298 0.57 . . . . 0.0 110.208 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.756 ' N ' HD23 ' A' ' 56' ' ' LEU . 2.9 t0 -54.6 -26.71 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.607 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.99 -53.03 62.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.663 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.859 ' CE ' HD21 ' A' ' 83' ' ' LEU . 2.5 ptp -60.54 -53.73 53.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.01 0.433 . . . . 0.0 110.456 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.67 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.3 mtm . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.757 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.564 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.487 0.184 . . . . 0.0 110.609 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -63.71 -140.45 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.51 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.6 OUTLIER 165.61 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.256 0.55 . . . . 0.0 111.392 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.865 ' CD1' HG11 ' B' ' 85' ' ' VAL . 0.8 OUTLIER -46.05 -61.81 1.6 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.585 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.18 -30.43 38.81 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.267 -179.35 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.4 OUTLIER -46.58 -31.35 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.784 179.397 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.589 ' HB3' ' CD1' ' A' ' 17' ' ' PHE . 0.8 OUTLIER -79.36 -54.38 6.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.771 178.332 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.52 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 6.3 mt -61.07 -34.04 74.28 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.617 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.534 ' HB2' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -72.38 -34.57 68.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.054 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.847 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 0.3 OUTLIER -67.83 -57.83 5.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.685 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.973 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.27 -43.77 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.112 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.02 -50.35 51.66 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.81 -37.32 43.25 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.659 177.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.859 HD21 ' CE ' ' A' ' 59' ' ' MET . 7.6 mt -64.01 -45.46 88.85 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.737 0.303 . . . . 0.0 110.219 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 88' ' ' HIS . . . -55.25 -32.75 62.58 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.338 0.59 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CD1' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.48 9.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.666 -179.487 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -113.32 12.08 18.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.299 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.92 -39.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.677 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.468 ' NE2' ' CE2' ' A' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.61 12.26 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.774 0.321 . . . . 0.0 111.19 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.7 89.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.152 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.415 ' H ' HG22 ' A' ' 92' ' ' VAL . 1.1 m 176.55 107.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.664 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.752 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 75.88 -48.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 85' ' ' VAL . 31.2 m . . . . . 0 C--N 1.332 -0.16 0 CA-C-O 120.885 0.374 . . . . 0.0 111.654 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.661 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.392 0.615 . . . . 0.0 111.171 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -43.95 9.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.326 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.853 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -68.77 -38.08 79.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.277 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.661 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.2 OUTLIER -52.12 -37.04 52.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.667 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -26.88 42.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.802 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.468 ' SG ' HG11 ' A' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.39 66.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.397 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.056 HG22 HD11 ' B' ' 14' ' ' ILE . 2.1 mp -60.96 -56.9 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 120.768 0.318 . . . . 0.0 111.132 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.904 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -54.0 -27.51 32.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.19 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -62.67 -55.54 25.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.817 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 1.024 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -71.37 -41.72 69.36 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.056 HD11 HG22 ' B' ' 10' ' ' ILE . 5.0 mt -56.1 -29.3 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 121.913 -0.492 . . . . 0.0 112.136 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.13 -32.84 21.09 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.554 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 1.024 HG22 ' O ' ' B' ' 13' ' ' LEU . 14.4 m -54.74 -31.4 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.74 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.28 -58.16 3.27 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.373 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.783 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.9 mm-40 -48.56 -30.73 5.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.622 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -62.06 -51.31 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.873 0.368 . . . . 0.0 110.495 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.679 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.31 -33.05 37.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.804 0.812 . . . . 0.0 109.631 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.599 ' HB2' ' HB2' ' B' ' 30' ' ' LEU . . . -90.42 20.04 4.8 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.213 -1.358 . . . . 0.0 111.743 -178.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.406 179.919 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.598 0.237 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.22 -176.4 4.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.363 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.679 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -135.48 -129.14 0.15 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.183 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.67 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -173.82 131.04 0.42 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -49.49 -42.62 43.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.82 0.343 . . . . 0.0 110.643 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 1.017 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -75.18 -43.14 53.87 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.256 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.509 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.1 mt-10 -55.13 -28.98 56.62 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.401 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.72 19.44 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.038 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 1.017 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.84 62.15 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.987 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.409 ' N ' ' O ' ' B' ' 33' ' ' THR . 2.1 t -81.31 -53.8 6.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.309 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.883 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -62.44 -35.86 80.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.363 179.553 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.558 ' HE2' HD13 ' B' ' 43' ' ' LEU . 4.1 ttm -46.79 -36.87 7.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.005 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.659 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 23.2 m-80 -64.01 -19.46 65.2 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.952 HG23 ' HG2' ' B' ' 42' ' ' GLU . 4.5 t -83.94 -30.82 25.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.0 OUTLIER -135.4 -37.94 0.76 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -178.118 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.826 HD21 HD11 ' A' ' 10' ' ' ILE . 19.0 mt -104.68 36.07 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.41 0.624 . . . . 0.0 110.184 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.659 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -79.37 -38.23 35.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.14 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.69 -24.32 14.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.805 179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.459 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 3.1 m-85 -100.25 27.12 5.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.77 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 82.6 p . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.042 -179.931 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.535 HG22 ' HB1' ' B' ' 86' ' ' ALA . 86.6 t . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.706 0.289 . . . . 0.0 111.261 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.755 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -69.35 -51.72 34.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 110.175 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.755 ' N ' HD23 ' B' ' 56' ' ' LEU . 2.9 t0 -54.5 -26.85 33.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.9 -53.08 62.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.617 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.87 ' CE ' HD21 ' B' ' 83' ' ' LEU . 2.5 ptp -60.56 -53.8 53.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.373 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.699 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.2 mtm . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.75 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.583 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.485 0.183 . . . . 0.0 110.536 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 1.038 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -63.7 -140.45 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.506 ' O ' ' CE2' ' B' ' 76' ' ' PHE . 0.6 OUTLIER 165.66 175.7 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.177 0.513 . . . . 0.0 111.428 178.733 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CD1' HG11 ' A' ' 85' ' ' VAL . 0.9 OUTLIER -46.04 -61.8 1.6 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -177.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.582 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.29 -30.42 38.28 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.211 -179.266 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 1.038 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.4 OUTLIER -46.45 -31.49 2.72 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.873 179.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.593 ' HB3' ' CD1' ' B' ' 17' ' ' PHE . 0.8 OUTLIER -79.18 -54.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 120.462 -0.495 . . . . 0.0 109.818 178.242 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.526 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 6.3 mt -60.96 -34.02 74.11 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.716 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.536 ' HB2' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -72.44 -34.55 67.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.043 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.829 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 0.3 OUTLIER -67.86 -57.82 5.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.645 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.981 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.23 -43.77 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.135 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.1 -50.34 52.0 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.438 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.86 -37.34 43.67 Favored Glycine 0 CA--C 1.52 0.405 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.633 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.87 HD21 ' CE ' ' B' ' 59' ' ' MET . 7.7 mt -64.02 -45.34 89.34 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.773 0.321 . . . . 0.0 110.253 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.457 ' HA ' ' CD2' ' B' ' 88' ' ' HIS . . . -55.32 -32.78 62.76 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.3 0.572 . . . . 0.0 110.663 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.865 HG11 ' CD1' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.34 -17.29 9.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.727 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.535 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -113.41 12.1 18.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.368 -179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.89 -39.66 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.678 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.459 ' NE2' ' CE2' ' B' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.63 12.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.819 0.343 . . . . 0.0 111.143 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.69 89.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.154 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.409 ' H ' HG22 ' B' ' 92' ' ' VAL . 1.1 m 176.54 107.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.626 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.749 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 75.91 -49.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.156 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.441 HG13 ' O ' ' B' ' 85' ' ' VAL . 30.9 m . . . . . 0 C--N 1.333 -0.13 0 CA-C-O 120.862 0.363 . . . . 0.0 111.663 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.641 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 121.482 0.658 . . . . 0.0 111.392 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 6' ' ' THR . 0.7 OUTLIER -45.01 -48.24 11.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.303 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.9 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.7 m -65.26 -39.7 92.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.385 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.641 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.3 mm-40 -51.76 -45.91 63.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.498 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -26.78 60.93 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.569 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -63.6 -52.31 61.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.956 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -55.69 -57.12 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 120.694 0.283 . . . . 0.0 111.056 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.881 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.8 OUTLIER -54.59 -27.42 38.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.025 0.44 . . . . 0.0 110.756 179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.789 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.07 -55.51 24.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.081 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' B' ' 13' ' ' LEU . 4.0 mm? -72.14 -30.97 65.55 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.022 HD11 HG22 ' A' ' 10' ' ' ILE . 5.5 mt -69.8 -38.25 75.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 111.95 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.65 64.06 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.678 -1.147 . . . . 0.0 112.023 -176.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.9 m -52.27 -40.0 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.506 ' N ' HG23 ' A' ' 16' ' ' VAL . 31.3 t80 -72.85 -58.21 3.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.296 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.793 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.0 mm-40 -49.09 -49.02 43.74 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -51.28 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.525 -178.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.502 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.6 m-85 -80.59 -26.87 37.61 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.59 0.709 . . . . 0.0 110.206 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.748 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -90.39 20.07 4.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.781 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 0.26 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.556 -179.918 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.8 m . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.595 0.236 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.748 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 24.1 p -155.17 -176.91 6.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.989 0.423 . . . . 0.0 110.812 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 31' ' ' SER . 0.3 OUTLIER -147.78 -123.16 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.261 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.551 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -173.7 129.23 0.41 Allowed 'General case' 0 C--O 1.231 0.088 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.408 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -49.91 -40.71 44.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.165 -179.136 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.711 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.44 -42.72 67.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.936 0.398 . . . . 0.0 110.041 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.0 mt-10 -56.01 -29.65 60.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -68.62 -34.88 76.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.535 178.441 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -53.37 -59.08 5.03 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.699 0.761 . . . . 0.0 111.192 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' HG22 ' A' ' 41' ' ' THR . 3.0 t -57.88 -27.75 63.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.34 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' B' ' 6' ' ' THR . 8.7 t80 -57.69 -50.39 73.35 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.012 0.434 . . . . 0.0 110.267 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.719 ' HE3' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.39 -44.14 95.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.444 0.64 . . . . 0.0 110.107 179.05 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.44 -19.29 64.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.932 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 37' ' ' SER . 8.3 t -107.61 -52.69 2.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.455 ' N ' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -128.09 29.2 5.42 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -177.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.719 HD13 ' HE3' ' A' ' 39' ' ' MET . 7.8 mt -166.7 45.8 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.17 0.51 . . . . 0.0 110.604 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.87 -30.0 61.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.361 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.47 -29.49 61.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.879 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CD1' HD22 ' A' ' 43' ' ' LEU . 4.4 m-85 -83.28 -4.63 58.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.702 HG21 ' HB3' ' A' ' 39' ' ' MET . 1.4 p . . . . . 0 CA--C 1.532 0.264 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.668 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' A' ' 86' ' ' ALA . 48.9 t . . . . . 0 CA--C 1.527 0.06 0 CA-C-O 120.918 0.39 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.665 HD23 ' C ' ' A' ' 56' ' ' LEU . 7.0 tt -75.16 -52.15 11.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.969 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.48 -26.81 44.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.028 -178.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.57 -53.79 30.68 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.696 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -75.55 -43.09 50.41 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.11 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.443 ' HE1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.664 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.891 0.377 . . . . 0.0 111.109 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.459 HD22 ' HA ' ' A' ' 71' ' ' LEU . 0.4 OUTLIER -69.37 -137.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.635 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 2.5 t70 173.72 161.49 0.16 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.466 0.575 . . . . 0.0 110.879 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.939 ' CD2' HG11 ' B' ' 85' ' ' VAL . 51.5 p90 -55.39 -58.85 6.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.289 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -79.96 -22.59 42.44 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 119.824 -0.751 . . . . 0.0 110.516 -179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.5 mt-10 -44.76 -38.09 4.22 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.506 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 1.4 t80 -76.84 -54.71 6.25 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 177.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' B' ' 77' ' ' LEU . 0.0 OUTLIER -48.55 -33.94 10.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.599 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -76.38 -52.39 9.99 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.686 178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.978 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -58.5 -59.07 5.95 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.951 -179.073 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.24 -41.41 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 O-C-N 123.606 0.566 . . . . 0.0 111.212 179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.459 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.83 -50.82 48.55 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 119.68 -1.247 . . . . 0.0 110.22 178.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -60.71 -35.91 90.66 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 120.455 -0.879 . . . . 0.0 111.846 177.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.978 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.8 mt -63.92 -38.32 90.66 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.3 -35.73 65.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.095 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.938 HG11 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.81 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.67 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -113.86 16.14 18.46 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.163 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.406 ' N ' ' O ' ' A' ' 83' ' ' LEU . 45.1 t -162.76 -42.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.825 -179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -99.01 78.78 2.29 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 111.855 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 90' ' ' SER . 6.0 mp0 53.37 -163.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.292 179.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 3.2 m 81.7 -69.56 0.08 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.247 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.57 -37.52 4.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.054 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 92' ' ' VAL . 4.2 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.651 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.429 0.633 . . . . 0.0 111.476 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' B' ' 6' ' ' THR . 0.7 OUTLIER -44.96 -48.25 11.4 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.255 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 20.1 m -65.31 -39.69 92.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.326 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.651 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.74 -45.87 63.83 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.458 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -26.77 60.86 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.563 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -63.48 -52.41 61.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.032 179.791 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.124 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -55.6 -57.07 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.638 0.256 . . . . 0.0 111.117 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.8 OUTLIER -54.67 -27.43 40.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 110.729 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.804 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.05 -55.52 24.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.084 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' A' ' 13' ' ' LEU . 4.0 mm? -72.16 -31.02 65.56 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.124 HD11 HG22 ' B' ' 10' ' ' ILE . 5.6 mt -69.8 -38.2 75.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.344 0.592 . . . . 0.0 111.902 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.18 -34.58 63.82 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.963 -176.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' B' ' 13' ' ' LEU . 16.0 m -52.27 -40.07 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 177.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.502 ' N ' HG23 ' B' ' 16' ' ' VAL . 31.4 t80 -72.77 -58.1 3.6 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.422 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.0 mm-40 -49.32 -48.84 46.04 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.28 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.66 -51.25 22.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.511 -178.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.521 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.6 m-85 -80.53 -26.9 37.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.521 0.677 . . . . 0.0 110.144 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -90.4 20.03 4.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.705 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.594 -179.906 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.6 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.692 0.282 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.744 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 24.2 p -155.16 -176.98 6.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.016 0.436 . . . . 0.0 110.839 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.558 HD22 ' N ' ' B' ' 31' ' ' SER . 0.3 OUTLIER -147.74 -123.2 0.06 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.31 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.558 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.3 OUTLIER -173.66 129.21 0.42 Allowed 'General case' 0 C--O 1.231 0.116 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.32 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.413 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -49.8 -40.79 42.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.19 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.722 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.34 -42.77 68.12 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.075 179.591 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.511 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.0 mt-10 -55.92 -29.77 60.58 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -68.57 -34.86 76.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.521 178.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.722 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -53.4 -59.12 4.99 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 111.123 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.525 ' O ' HG22 ' B' ' 41' ' ' THR . 3.0 t -57.84 -27.74 63.47 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.386 -178.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' A' ' 6' ' ' THR . 8.6 t80 -57.64 -50.49 72.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.979 0.418 . . . . 0.0 110.26 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.698 ' HB3' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -60.32 -44.07 95.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.438 0.637 . . . . 0.0 110.147 179.064 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -63.5 -19.29 64.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.92 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.525 HG22 ' O ' ' B' ' 37' ' ' SER . 8.2 t -107.68 -52.59 2.74 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.451 ' N ' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -128.16 29.2 5.41 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.158 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.667 HD13 ' HE3' ' B' ' 39' ' ' MET . 7.8 mt -166.7 45.81 0.06 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.138 0.494 . . . . 0.0 110.604 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -74.83 -29.95 61.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.431 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.49 -29.5 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.856 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.42 ' CD1' HD22 ' B' ' 43' ' ' LEU . 4.4 m-85 -83.32 -4.61 58.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.201 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.698 HG21 ' HB3' ' B' ' 39' ' ' MET . 1.4 p . . . . . 0 CA--C 1.53 0.207 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.705 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' B' ' 86' ' ' ALA . 49.1 t . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.912 0.386 . . . . 0.0 111.534 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.655 HD23 ' C ' ' B' ' 56' ' ' LEU . 7.0 tt -75.11 -52.23 11.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.976 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.52 -26.77 44.91 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.02 -178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -53.75 31.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.705 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -75.53 -43.09 50.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.444 ' HE1' ' HG ' ' B' ' 56' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.683 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.417 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.88 0.372 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.445 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.4 OUTLIER -69.25 -137.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 2.5 t70 173.69 161.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.409 0.55 . . . . 0.0 110.969 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.938 ' CD2' HG11 ' A' ' 85' ' ' VAL . 51.6 p90 -55.37 -58.83 6.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.4 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.584 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.2 OUTLIER -79.92 -22.55 42.59 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.556 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.823 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.5 mt-10 -44.81 -38.11 4.29 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 1.4 t80 -76.77 -54.71 6.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -48.6 -33.85 10.54 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 177.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -76.48 -52.36 9.96 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.654 178.027 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.973 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -58.55 -58.94 6.35 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.977 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.97 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.27 -41.53 65.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 O-C-N 123.572 0.545 . . . . 0.0 111.158 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.72 -50.82 47.87 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 119.75 -1.215 . . . . 0.0 110.261 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.49 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -60.77 -35.88 90.77 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.847 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.973 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.9 mt -63.87 -38.35 90.77 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.608 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.37 -35.58 65.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.098 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.939 HG11 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.54 -17.89 9.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 114.732 -1.122 . . . . 0.0 111.706 -179.538 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.78 15.98 18.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.416 ' N ' ' O ' ' B' ' 83' ' ' LEU . 45.3 t -162.74 -42.41 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.852 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.404 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.6 OUTLIER -99.12 78.86 2.28 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.923 0.392 . . . . 0.0 111.869 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' B' ' 90' ' ' SER . 6.0 mp0 53.37 -163.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.415 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.411 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 3.2 m 81.72 -69.64 0.08 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.241 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.51 -37.52 4.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.103 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.364 -179.815 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 121.328 0.585 . . . . 0.0 111.049 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.76 -46.44 10.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.114 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.999 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.19 -41.76 96.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.18 0.514 . . . . 0.0 109.932 179.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.5 mt-10 -51.66 -34.71 39.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.37 -35.43 40.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.842 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HB2' HD22 ' B' ' 13' ' ' LEU . 3.4 p -65.45 -40.7 93.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.066 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.039 HG22 HD11 ' A' ' 14' ' ' ILE . 2.6 mp -69.89 -56.17 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.402 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.1 -27.47 14.18 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.604 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.636 ' O ' HG13 ' A' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.887 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.953 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -59.75 -29.67 68.33 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.118 0.485 . . . . 0.0 112.086 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.039 HD11 HG22 ' A' ' 10' ' ' ILE . 8.0 mt -70.66 -39.04 75.37 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 CA-C-O 121.541 0.686 . . . . 0.0 110.539 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.5 -32.79 58.53 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.293 -176.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.953 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.0 m -52.09 -39.09 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.497 ' N ' HG23 ' A' ' 16' ' ' VAL . 9.1 t80 -77.85 -58.47 3.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.917 179.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.6 mm-40 -48.84 -30.97 6.39 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -51.56 68.95 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.804 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.763 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.05 -49.38 10.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.794 0.807 . . . . 0.0 109.962 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -57.25 -52.12 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.782 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 -179.964 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.9 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.99 0.424 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 31.7 p -123.57 -178.33 3.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.262 0.553 . . . . 0.0 111.031 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -131.73 -139.86 0.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.787 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.516 ' H ' HD22 ' A' ' 30' ' ' LEU . 1.3 p -164.33 136.72 4.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 3.4 pttt -49.72 -35.76 23.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.925 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.951 ' HA ' HD23 ' A' ' 36' ' ' LEU . 12.9 m -74.28 -53.18 10.26 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.856 -0.338 . . . . 0.0 111.779 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.462 ' HB3' ' CD1' ' A' ' 20' ' ' TYR . 25.4 mt-10 -55.63 -28.2 53.96 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.54 ' CE2' ' CD2' ' A' ' 76' ' ' PHE . 1.3 t80 -78.18 -43.02 29.73 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.209 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.951 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -68.23 -21.02 64.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.48 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -80.99 -26.55 36.42 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.141 0.496 . . . . 0.0 109.831 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.464 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 45.8 t80 -69.5 -24.48 63.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.666 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.593 ' CG ' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -72.44 -41.68 65.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.615 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -73.99 -19.4 60.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.4 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.4 p -106.32 -76.53 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 38' ' ' PHE . 2.0 mm-40 -68.41 -33.15 73.71 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.778 HD22 ' CD2' ' A' ' 46' ' ' PHE . 15.5 mt -121.95 43.73 2.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.074 0.464 . . . . 0.0 110.686 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -74.68 -25.02 58.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.809 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.08 -23.23 67.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.812 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.778 ' CD2' HD22 ' A' ' 43' ' ' LEU . 16.2 m-85 -95.55 -27.89 15.13 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.915 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.593 HG21 ' CG ' ' A' ' 39' ' ' MET . 11.7 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.839 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 86' ' ' ALA . 23.6 t . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 121.066 0.46 . . . . 0.0 111.437 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.546 HD13 ' CG ' ' A' ' 39' ' ' MET . 7.8 tp -75.1 -51.23 13.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.735 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.65 -33.76 64.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.489 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.27 -40.31 95.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.694 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.883 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -61.69 -54.21 45.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.041 0.448 . . . . 0.0 111.199 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.558 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.431 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.623 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.903 0.382 . . . . 0.0 111.119 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.716 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.72 -142.5 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.403 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.491 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 171.74 -178.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.23 0.538 . . . . 0.0 111.731 179.121 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.5 p90 -61.77 -58.15 9.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.639 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.466 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 43.0 tp60 -74.74 -25.38 59.07 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.608 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.789 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.95 -37.57 4.07 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.54 ' CD2' ' CE2' ' A' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.47 5.73 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.833 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.675 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.5 mt -53.98 -33.89 58.26 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.466 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.79 -50.05 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.242 177.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.789 HD13 ' O ' ' A' ' 75' ' ' GLU . 5.0 mp -58.05 -57.52 12.47 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.016 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HG12 ' B' ' 10' ' ' ILE . 0.1 OUTLIER -71.1 -46.03 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.027 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.668 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.91 -50.13 51.96 Favored Glycine 0 C--N 1.333 0.412 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.65 -35.12 37.17 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.687 178.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.883 HD21 ' CE ' ' A' ' 59' ' ' MET . 12.6 mt -61.74 -45.99 91.57 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.965 0.412 . . . . 0.0 109.979 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.48 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.37 -31.81 62.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.873 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.902 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.41 9.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.649 -179.598 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.761 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.73 13.01 17.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.341 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.77 -39.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.578 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.39 67.15 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.697 0.284 . . . . 0.0 111.737 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.7 -168.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m 76.09 5.51 3.75 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.652 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.503 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER 170.35 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 179.674 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.165 179.976 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.682 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.317 0.58 . . . . 0.0 111.142 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.69 -46.48 10.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.094 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.99 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.16 -41.82 97.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.894 179.048 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.682 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.5 mt-10 -51.65 -34.71 39.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.936 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.41 -35.38 40.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.757 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.616 ' HB2' HD22 ' A' ' 13' ' ' LEU . 3.4 p -65.62 -40.59 92.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.07 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.6 mp -69.85 -56.2 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.412 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.959 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.14 -27.43 14.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.878 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.932 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -59.84 -29.56 68.36 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.12 0.486 . . . . 0.0 112.085 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.0 mt -70.73 -38.96 74.99 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 121.478 0.656 . . . . 0.0 110.526 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.8 58.43 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.387 -1.279 . . . . 0.0 112.311 -176.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.932 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.2 m -52.15 -39.05 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 177.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.496 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 9.0 t80 -77.9 -58.52 3.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.839 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.809 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.7 mm-40 -48.91 -30.84 6.36 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -51.65 68.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.702 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.753 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.94 -49.39 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.869 0.842 . . . . 0.0 109.995 178.459 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -57.28 -52.08 66.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.23 -1.35 . . . . 0.0 111.859 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.987 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' B' ' 28' ' ' VAL . 26.8 m . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.004 0.431 . . . . 0.0 111.018 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.9 p -123.65 -178.36 4.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.248 0.546 . . . . 0.0 111.025 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.753 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -131.63 -139.83 0.21 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.877 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.496 ' H ' HD22 ' B' ' 30' ' ' LEU . 1.3 p -164.43 136.63 4.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -49.59 -35.67 21.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.991 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.959 ' HA ' HD23 ' B' ' 36' ' ' LEU . 12.5 m -74.46 -53.06 10.28 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.755 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' ' CD1' ' B' ' 20' ' ' TYR . 25.4 mt-10 -55.68 -28.17 54.14 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.547 ' CE2' ' CD2' ' B' ' 76' ' ' PHE . 1.3 t80 -78.27 -42.95 29.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.183 178.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.959 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -68.3 -20.98 64.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.474 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -81.03 -26.54 36.31 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.133 0.492 . . . . 0.0 109.832 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB2' ' CE2' ' B' ' 20' ' ' TYR . 45.9 t80 -69.46 -24.54 63.81 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.588 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.6 ' CG ' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -72.39 -41.65 66.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.611 -179.595 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 0.1 OUTLIER -74.08 -19.34 60.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.349 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 28.5 p -106.32 -76.68 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.454 ' CB ' ' CZ ' ' B' ' 38' ' ' PHE . 2.0 mm-40 -68.33 -33.06 73.61 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.77 HD22 ' CD2' ' B' ' 46' ' ' PHE . 15.3 mt -122.16 43.93 2.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.134 0.492 . . . . 0.0 110.589 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.566 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -74.69 -25.03 58.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.88 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.05 -23.24 67.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.784 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.77 ' CD2' HD22 ' B' ' 43' ' ' LEU . 16.2 m-85 -95.59 -27.94 15.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.934 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.6 HG21 ' CG ' ' B' ' 39' ' ' MET . 11.7 t . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.918 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.773 HG22 ' O ' ' B' ' 86' ' ' ALA . 23.7 t . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 121.078 0.466 . . . . 0.0 111.426 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.544 HD13 ' CG ' ' B' ' 39' ' ' MET . 7.7 tp -75.06 -51.24 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.723 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.62 -33.76 64.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.508 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -40.3 95.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -61.78 -54.24 45.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.176 -179.4 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.568 ' HE3' ' HA ' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.687 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.48 -179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.612 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.775 0.321 . . . . 0.0 111.233 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.718 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -65.86 -142.44 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.417 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.485 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 171.75 -178.29 0.06 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.197 0.523 . . . . 0.0 111.799 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.902 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.0 p90 -61.77 -58.22 8.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.648 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.463 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 42.9 tp60 -74.67 -25.37 59.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.623 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.87 -37.63 4.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.192 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.547 ' CD2' ' CE2' ' B' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.33 5.86 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.866 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.668 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.4 mt -54.15 -33.81 58.86 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.463 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.85 -50.02 14.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.233 177.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.795 HD13 ' O ' ' B' ' 75' ' ' GLU . 5.0 mp -58.01 -57.65 11.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.955 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.754 HD11 HG12 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -70.94 -46.13 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.071 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.675 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.89 -50.22 51.43 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.15 36.5 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.68 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 12.7 mt -61.66 -45.98 91.7 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 121.032 0.444 . . . . 0.0 110.009 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.506 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.39 -31.7 62.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.007 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.38 -17.52 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.61 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.773 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.63 12.96 17.34 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.361 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.474 ' HG ' ' HD1' ' B' ' 46' ' ' PHE . 0.5 OUTLIER -157.79 -39.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.625 -179.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.29 67.07 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.75 -168.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.363 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 7.8 m 76.1 5.4 3.75 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.622 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.502 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.2 OUTLIER 170.36 -52.04 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.78 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.126 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.688 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.191 0 CA-C-O 121.374 0.607 . . . . 0.0 111.059 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.81 -47.76 10.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.034 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.905 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -63.42 -39.18 93.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.218 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.688 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.6 OUTLIER -52.28 -34.28 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.39 -39.68 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.01 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.8 p -58.6 -42.47 88.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.431 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.041 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -67.5 -56.05 14.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.906 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.88 -27.34 12.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.538 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.5 m -71.58 -55.84 7.0 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.946 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -63.55 -28.42 69.93 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.041 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -70.64 -37.01 67.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.574 0.702 . . . . 0.0 110.645 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.47 -33.08 58.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.278 -176.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.946 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.5 m -53.19 -38.95 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 177.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.572 ' CD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -75.25 -57.7 3.73 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.535 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -48.87 -30.39 5.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -52.12 66.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.501 -0.479 . . . . 0.0 111.147 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.882 ' HB3' HD21 ' A' ' 30' ' ' LEU . 17.4 m-85 -81.17 -47.81 12.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.98 -25.05 57.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.645 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.349 -179.887 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.586 0.232 . . . . 0.0 111.574 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 16.6 p -139.32 178.73 6.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.127 0.489 . . . . 0.0 111.148 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.882 HD21 ' HB3' ' A' ' 20' ' ' TYR . 1.3 tt -125.27 -115.28 0.29 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.968 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.506 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 43.2 t 176.01 129.14 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.67 -35.7 22.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.717 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.2 -44.15 54.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -58.48 -28.84 65.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 0.0 110.1 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -70.49 -27.95 64.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.917 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.717 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.46 -58.98 5.72 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.677 0.751 . . . . 0.0 111.121 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.951 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 m -56.17 -44.09 79.02 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.46 -178.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' B' ' 6' ' ' THR . 10.2 t80 -57.57 -29.08 64.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.812 0.339 . . . . 0.0 110.748 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -76.52 -41.28 47.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.099 0.476 . . . . 0.0 110.759 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -73.67 -19.46 60.82 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.244 -179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 37' ' ' SER . 0.7 OUTLIER -98.18 -66.93 0.87 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.597 ' H ' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -96.29 -20.98 18.12 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -176.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.585 HD21 HD11 ' B' ' 10' ' ' ILE . 31.3 mt -120.61 45.89 2.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.203 0.525 . . . . 0.0 110.59 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -32.08 35.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.077 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.47 -23.65 51.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.839 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -90.42 -8.48 50.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.112 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.436 ' CG2' ' HG2' ' A' ' 39' ' ' MET . 6.7 p . . . . . 0 C--N 1.332 -0.177 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.008 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.782 0.325 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.2 OUTLIER -64.37 -50.37 67.98 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.89 -45.13 78.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -25.33 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.891 0.377 . . . . 0.0 110.967 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 1.032 ' HG3' HD21 ' A' ' 83' ' ' LEU . 9.5 mmm -65.62 -54.6 25.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.489 0.662 . . . . 0.0 112.006 -179.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.677 ' HA ' ' HE3' ' A' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.239 0 CA-C-N 114.722 -1.127 . . . . 0.0 112.409 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.862 0.363 . . . . 0.0 111.15 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.4 OUTLIER -69.56 -140.7 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.542 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.6 OUTLIER 173.45 169.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 0.0 111.062 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HB2' HG11 ' B' ' 85' ' ' VAL . 2.8 m-85 -59.13 -62.33 1.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.91 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.459 ' O ' ' N ' ' A' ' 78' ' ' ASN . 50.0 tp60 -67.84 -28.86 67.91 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.65 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.638 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.51 -40.53 5.69 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 110.28 179.7 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' CG2' ' A' ' 16' ' ' VAL . 1.7 t80 -72.05 -53.99 11.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.277 178.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.501 HD21 ' CB ' ' A' ' 13' ' ' LEU . 5.7 mt -54.75 -33.81 61.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.459 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.4 m-20 -74.41 -49.85 20.9 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.38 178.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.891 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 7.3 mp -65.03 -58.29 6.46 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.721 -179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.568 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -65.91 -46.68 87.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 O-C-N 123.351 0.407 . . . . 0.0 111.259 179.481 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.486 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -55.72 -50.43 60.83 Favored Glycine 0 CA--C 1.506 -0.488 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.61 -29.89 54.96 Favored Glycine 0 CA--C 1.523 0.54 0 C-N-CA 120.411 -0.9 . . . . 0.0 111.663 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 1.032 HD21 ' HG3' ' A' ' 59' ' ' MET . 24.6 mt -66.57 -47.32 73.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.075 0.464 . . . . 0.0 110.198 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.21 -34.71 64.16 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.801 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.498 HG11 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.08 -17.56 9.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.31 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.06 16.61 16.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.358 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' A' ' 83' ' ' LEU . 22.6 t -163.55 -30.85 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.587 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 57.2 t60 -84.5 51.73 2.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.817 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.64 32.6 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -94.17 -67.03 0.88 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.486 179.623 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.19 -35.96 7.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.337 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.451 HG21 ' HA ' ' A' ' 87' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.878 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.689 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.356 0.598 . . . . 0.0 111.018 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.84 -47.73 11.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.027 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.908 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.9 OUTLIER -63.44 -39.13 93.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.247 179.221 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.689 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.6 OUTLIER -52.39 -34.24 47.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.705 179.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.42 -39.58 32.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.987 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.8 p -58.64 -42.51 88.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.372 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -67.57 -56.05 14.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.819 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.979 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.9 -27.23 12.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.564 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.5 m -71.75 -55.67 7.2 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.942 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -63.68 -28.36 69.84 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.105 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -70.73 -36.96 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.562 0.696 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.54 -33.08 58.57 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.233 -176.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.942 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.7 m -53.23 -38.86 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.58 ' CD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -75.24 -57.75 3.71 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.58 179.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -48.96 -30.38 5.91 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -52.29 65.96 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.101 -178.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.852 ' HB3' HD21 ' B' ' 30' ' ' LEU . 17.4 m-85 -81.04 -47.89 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.767 0.794 . . . . 0.0 109.873 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.87 -25.08 55.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.632 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.389 -179.842 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.641 0.258 . . . . 0.0 111.579 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.412 HG22 ' O ' ' B' ' 71' ' ' LEU . 16.6 p -139.3 178.77 6.95 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.141 0.496 . . . . 0.0 111.166 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.852 HD21 ' HB3' ' B' ' 20' ' ' TYR . 1.3 tt -125.29 -115.34 0.28 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.951 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.51 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 43.4 t 176.01 129.16 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.444 ' HB3' ' HE2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.7 -35.79 23.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.914 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.733 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.07 -44.2 54.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.886 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.7 OUTLIER -58.57 -28.78 65.86 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.094 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -70.38 -28.09 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.964 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.733 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.51 -58.89 6.07 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.714 0.769 . . . . 0.0 111.057 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.968 ' O ' HG22 ' B' ' 41' ' ' THR . 3.2 m -56.13 -44.18 78.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.421 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.438 ' HE1' HG21 ' A' ' 6' ' ' THR . 10.2 t80 -57.47 -29.14 64.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.899 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -76.5 -41.34 47.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.692 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -73.61 -19.49 60.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.221 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.968 HG22 ' O ' ' B' ' 37' ' ' SER . 0.6 OUTLIER -98.22 -66.93 0.87 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -177.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.6 ' H ' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -96.23 -20.92 18.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 -176.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.588 HD21 HD11 ' A' ' 10' ' ' ILE . 31.6 mt -120.57 45.78 2.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.618 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.75 -32.14 35.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.998 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.51 -23.67 51.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.754 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -90.35 -8.52 50.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.18 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.43 ' CG2' ' HG2' ' B' ' 39' ' ' MET . 6.6 p . . . . . 0 C--N 1.333 -0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.024 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t . . . . . 0 CA--C 1.528 0.127 0 CA-C-O 120.787 0.327 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' ' HG2' ' B' ' 59' ' ' MET . 0.2 OUTLIER -64.46 -50.28 68.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.84 -45.2 78.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -25.23 62.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.95 0.405 . . . . 0.0 111.024 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 1.069 ' HG3' HD21 ' B' ' 83' ' ' LEU . 9.5 mmm -65.65 -54.62 25.13 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.497 0.665 . . . . 0.0 112.021 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.667 ' HA ' ' HE3' ' B' ' 60' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.2 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.436 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.933 0.397 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.585 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.4 OUTLIER -69.66 -140.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.6 OUTLIER 173.36 169.86 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.933 0.396 . . . . 0.0 111.044 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.498 ' HB2' HG11 ' A' ' 85' ' ' VAL . 2.8 m-85 -59.16 -62.32 1.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.86 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' B' ' 78' ' ' ASN . 49.9 tp60 -67.97 -28.75 67.72 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.625 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.623 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.54 -40.52 5.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 110.201 179.688 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.462 ' CE1' ' CG2' ' B' ' 16' ' ' VAL . 1.7 t80 -72.05 -54.04 11.05 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.294 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.506 HD21 ' CB ' ' B' ' 13' ' ' LEU . 5.7 mt -54.68 -33.84 61.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.402 0.62 . . . . 0.0 109.516 178.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.4 m-20 -74.44 -49.85 20.78 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.33 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.906 ' HG ' ' HB3' ' B' ' 59' ' ' MET . 7.2 mp -65.01 -58.31 6.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.732 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.564 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -65.97 -46.55 87.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 O-C-N 123.386 0.429 . . . . 0.0 111.283 179.524 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.496 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -55.72 -50.47 60.61 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.45 -30.03 54.68 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.467 -0.873 . . . . 0.0 111.69 177.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 1.069 HD21 ' HG3' ' B' ' 59' ' ' MET . 24.7 mt -66.69 -47.22 73.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.043 0.449 . . . . 0.0 110.177 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.572 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.24 -34.81 64.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.689 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.509 HG11 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.03 -17.48 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.364 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.09 16.56 16.0 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.244 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' B' ' 83' ' ' LEU . 22.8 t -163.53 -30.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.572 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 57.1 t60 -84.48 51.72 2.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.831 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.62 32.57 0.06 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 0.4 OUTLIER -94.09 -67.04 0.88 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 110.486 179.645 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.15 -36.05 7.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.389 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.442 HG21 ' CA ' ' B' ' 87' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.957 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.565 HG23 ' H ' ' A' ' 7' ' ' GLU . 10.1 t . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 121.67 0.748 . . . . 0.0 111.263 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.9 -48.04 11.24 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.868 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.824 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.9 m -67.11 -34.42 77.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.736 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.565 ' H ' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.91 -45.98 64.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.882 0.373 . . . . 0.0 110.579 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -26.81 66.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.401 178.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.449 ' CB ' ' HB3' ' B' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.678 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.022 HG12 HD11 ' B' ' 80' ' ' ILE . 1.6 mp -48.9 -56.11 2.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.877 0.37 . . . . 0.0 111.652 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.958 ' HA ' HD12 ' A' ' 14' ' ' ILE . 5.2 mt-10 -51.85 -27.19 11.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.722 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.4 m -62.09 -55.9 24.26 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.011 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -76.04 -27.83 57.46 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.018 HD11 HG22 ' A' ' 10' ' ' ILE . 7.2 mt -67.15 -37.3 78.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.489 0.662 . . . . 0.0 111.008 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.92 -32.59 57.48 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.565 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.011 HG22 ' O ' ' A' ' 13' ' ' LEU . 22.1 m -52.02 -38.2 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.482 ' N ' HG23 ' A' ' 16' ' ' VAL . 7.6 t80 -77.4 -58.42 3.29 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.244 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.805 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.7 mm-40 -49.12 -25.61 2.25 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.3 -52.74 36.84 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.916 -178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.908 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.1 m-85 -81.6 -39.47 24.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.828 0.823 . . . . 0.0 109.894 178.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.558 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -70.6 -27.82 64.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.853 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.303 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.567 -179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.422 HG13 ' N ' ' A' ' 29' ' ' THR . 12.2 p . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.695 0.283 . . . . 0.0 111.48 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HA ' ' A' ' 72' ' ' ASP . 2.5 p -134.93 154.76 51.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.908 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -111.05 -136.39 0.37 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.918 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.476 ' H ' HD22 ' A' ' 30' ' ' LEU . 6.5 t -168.01 133.84 1.94 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.771 0.32 . . . . 0.0 110.539 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.86 -39.97 40.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.739 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -69.17 -46.63 67.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.424 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.74 65.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.033 0.444 . . . . 0.0 110.287 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -69.31 -29.4 67.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.111 179.012 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.739 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -51.73 -59.06 4.73 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.636 0.731 . . . . 0.0 111.297 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -47.23 81.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.57 -1.195 . . . . 0.0 111.386 -178.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 42' ' ' GLU . 10.8 t80 -57.73 -51.07 71.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.673 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.439 ' HE3' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.551 179.76 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.75 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 89.3 m-20 -73.53 -19.84 60.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.881 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -118.97 -80.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.107 0.479 . . . . 0.0 111.501 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 38' ' ' PHE . 2.2 mm-40 -46.0 -38.58 7.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.027 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.84 HD21 HD11 ' B' ' 10' ' ' ILE . 23.3 mt -130.69 50.8 2.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.937 0.399 . . . . 0.0 110.679 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.75 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -80.78 -35.19 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.099 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.98 -25.06 57.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.162 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.454 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 43.6 m-85 -91.97 15.09 13.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.423 HG21 ' CG ' ' A' ' 39' ' ' MET . 26.3 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.492 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.617 HG22 ' O ' ' A' ' 86' ' ' ALA . 40.8 t . . . . . 0 CA--C 1.526 0.052 0 CA-C-O 120.766 0.317 . . . . 0.0 111.404 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.826 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -67.81 -51.68 45.85 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.152 0.501 . . . . 0.0 110.488 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.826 ' N ' HD23 ' A' ' 56' ' ' LEU . 1.7 t0 -55.11 -26.83 40.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.905 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.588 HH21 ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -61.97 -47.26 85.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.682 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.842 ' CE ' HD21 ' A' ' 83' ' ' LEU . 5.1 ptp -69.31 -53.78 17.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.642 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.0 mtm . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.898 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.507 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.1 mm-40 . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.699 0.285 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.698 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -64.49 -132.79 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.663 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.509 ' HA ' HG22 ' A' ' 29' ' ' THR . 2.3 t0 176.71 -171.37 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.81 0.732 . . . . 0.0 111.444 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.801 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.4 p90 -77.6 -54.87 5.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.489 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.478 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -77.63 -30.36 52.19 Favored 'General case' 0 CA--C 1.515 -0.37 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.326 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.726 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -44.83 -33.1 1.8 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -80.44 -54.4 5.73 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.847 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' B' ' 77' ' ' LEU . 6.9 mt -55.98 -33.37 64.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.408 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.14 -39.68 54.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.135 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.842 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.7 mp -64.56 -57.77 8.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.748 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.038 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.82 -43.71 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.139 179.427 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.71 -50.31 49.93 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.005 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.49 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.71 -35.52 38.57 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.359 -0.924 . . . . 0.0 111.427 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.842 HD21 ' CE ' ' A' ' 59' ' ' MET . 8.4 mt -62.19 -46.07 90.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.921 0.391 . . . . 0.0 110.098 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.32 -35.42 65.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 110.849 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.812 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -81.09 -17.15 12.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.115 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HG13 ' A' ' 92' ' ' VAL . . . -117.35 15.72 14.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.552 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -160.99 -27.43 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -179.443 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.525 ' HB2' ' O ' ' A' ' 84' ' ' ALA . 14.2 m-70 -93.79 27.56 2.68 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.611 -0.436 . . . . 0.0 112.159 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.783 ' HA ' HG23 ' A' ' 92' ' ' VAL . 1.4 mp0 59.34 16.51 5.11 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -72.94 -50.7 21.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.949 0.404 . . . . 0.0 109.95 179.334 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -113.03 -38.75 4.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.779 178.775 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.783 HG23 ' HA ' ' A' ' 89' ' ' GLU . 1.6 m . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.087 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.571 HG23 ' H ' ' B' ' 7' ' ' GLU . 10.1 t . . . . . 0 CA--C 1.517 -0.298 0 CA-C-O 121.625 0.726 . . . . 0.0 111.328 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.88 -48.14 11.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.801 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.801 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.8 m -67.06 -34.33 77.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.762 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.571 ' H ' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.99 -45.95 64.68 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.534 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -26.8 66.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.448 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.09 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.655 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.055 HG22 HD11 ' B' ' 14' ' ' ILE . 1.6 mp -48.94 -56.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.543 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 5.3 mt-10 -51.77 -27.27 11.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.7 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.3 m -62.07 -55.83 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 1.017 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -76.17 -27.75 57.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.055 HD11 HG22 ' B' ' 10' ' ' ILE . 7.1 mt -67.19 -37.27 78.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 O-C-N 121.558 -0.714 . . . . 0.0 110.964 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.99 -32.63 57.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.469 -1.241 . . . . 0.0 112.539 -176.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 1.017 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.0 m -52.05 -38.17 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' B' ' 16' ' ' VAL . 7.5 t80 -77.46 -58.38 3.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.155 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.7 mm-40 -49.17 -25.65 2.33 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.13 -52.83 36.83 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.891 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.929 ' HB3' HD21 ' B' ' 30' ' ' LEU . 8.1 m-85 -81.63 -39.44 24.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.808 0.813 . . . . 0.0 109.864 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.569 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -70.64 -27.83 64.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.816 -179.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.629 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.42 HG13 ' N ' ' B' ' 29' ' ' THR . 12.0 p . . . . . 0 CA--C 1.528 0.112 0 CA-C-O 120.709 0.29 . . . . 0.0 111.472 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.525 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 2.4 p -135.05 154.85 51.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.535 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.929 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -111.02 -136.37 0.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.015 179.817 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.474 ' H ' HD22 ' B' ' 30' ' ' LEU . 6.5 t -167.98 133.82 1.95 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.756 0.312 . . . . 0.0 110.577 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.81 -39.97 40.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.96 -179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -69.2 -46.65 66.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.58 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.419 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.76 65.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.953 0.406 . . . . 0.0 110.195 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.763 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -69.25 -29.51 67.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.069 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.61 -59.02 4.74 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.664 0.745 . . . . 0.0 111.371 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.42 -47.16 82.49 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.346 -178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' B' ' 42' ' ' GLU . 10.9 t80 -57.76 -51.07 71.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.65 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.456 ' HE3' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -63.29 -30.93 71.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.547 179.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.735 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 89.3 m-20 -73.48 -19.8 60.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.843 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -119.02 -80.38 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 0.0 111.491 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.444 ' HB2' ' CE1' ' B' ' 38' ' ' PHE . 2.1 mm-40 -46.03 -38.56 8.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.031 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 10' ' ' ILE . 23.4 mt -130.77 50.81 2.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.982 0.42 . . . . 0.0 110.662 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -80.77 -35.21 33.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.068 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.05 -24.99 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.175 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 43.9 m-85 -91.87 14.96 14.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.133 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.419 HG21 ' CG ' ' B' ' 39' ' ' MET . 26.3 p . . . . . 0 C--N 1.331 -0.208 0 CA-C-O 120.95 0.405 . . . . 0.0 110.445 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.623 HG22 ' O ' ' B' ' 86' ' ' ALA . 41.0 t . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.741 0.305 . . . . 0.0 111.314 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.835 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.2 OUTLIER -67.77 -51.71 45.72 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.216 0.532 . . . . 0.0 110.536 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.835 ' N ' HD23 ' B' ' 56' ' ' LEU . 1.7 t0 -55.09 -26.87 40.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.881 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . 0.59 HH21 ' HB2' ' B' ' 86' ' ' ALA . 0.2 OUTLIER -61.91 -47.19 86.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.708 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.854 ' CE ' HD21 ' B' ' 83' ' ' LEU . 5.1 ptp -69.44 -53.81 17.48 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.908 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.655 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.0 mtm . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.776 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.525 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.1 mm-40 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.762 0.315 . . . . 0.0 111.386 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.702 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -64.48 -132.81 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.489 ' HA ' HG22 ' B' ' 29' ' ' THR . 2.3 t0 176.67 -171.37 0.08 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.798 0.727 . . . . 0.0 111.409 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.812 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.4 p90 -77.65 -54.96 5.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.433 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -77.57 -30.38 52.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.319 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.72 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.79 -33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.858 0.361 . . . . 0.0 110.155 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.595 ' HD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -80.32 -54.42 5.74 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.882 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' A' ' 77' ' ' LEU . 6.9 mt -55.95 -33.37 64.7 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.412 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.12 -39.8 54.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.101 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.853 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.7 mp -64.36 -57.92 7.97 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.773 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 1.022 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.75 -43.77 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.137 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.69 -50.27 49.97 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.316 -0.945 . . . . 0.0 111.068 179.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.8 -35.45 39.06 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.394 178.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.854 HD21 ' CE ' ' B' ' 59' ' ' MET . 8.6 mt -62.29 -46.06 90.48 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.896 0.379 . . . . 0.0 110.048 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.52 ' O ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.42 -35.3 65.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.329 0.585 . . . . 0.0 110.812 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.801 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -81.08 -17.25 12.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.159 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.683 ' HA ' HG13 ' B' ' 92' ' ' VAL . . . -117.31 15.72 14.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.534 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.411 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.3 OUTLIER -160.98 -27.37 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.52 ' HB2' ' O ' ' B' ' 84' ' ' ALA . 14.1 m-70 -93.92 27.67 2.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.547 -0.461 . . . . 0.0 112.121 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.763 ' HA ' HG23 ' B' ' 92' ' ' VAL . 1.4 mp0 59.31 16.52 5.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.431 ' CB ' ' HA ' ' B' ' 85' ' ' VAL . 0.2 OUTLIER -72.88 -50.75 21.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.971 0.415 . . . . 0.0 109.931 179.359 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.712 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -113.06 -38.69 4.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.789 178.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.763 HG23 ' HA ' ' B' ' 89' ' ' GLU . 1.6 m . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.156 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.473 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 0.0 111.189 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.82 -49.06 10.97 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.421 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.939 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.25 -41.56 96.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.093 0.473 . . . . 0.0 110.194 179.207 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.473 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.0 OUTLIER -51.44 -31.61 23.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -28.31 41.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.928 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 4.3 p -73.95 -40.66 62.89 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.391 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 14' ' ' ILE . 2.5 mp -66.92 -56.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.902 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -52.18 -27.33 14.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.428 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.581 ' O ' HG13 ' A' ' 16' ' ' VAL . 5.9 m -72.19 -56.03 6.24 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -178.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.837 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -64.9 -27.5 68.9 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.077 HD11 HG22 ' A' ' 10' ' ' ILE . 12.8 mt -69.06 -37.35 76.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 CA-C-O 121.491 0.662 . . . . 0.0 110.611 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.615 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -76.49 -39.69 52.41 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 114.027 -1.442 . . . . 0.0 112.402 -176.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 13' ' ' LEU . 20.2 m -50.96 -33.89 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 1.3 t80 -80.55 -59.01 2.85 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.222 -1.354 . . . . 0.0 113.249 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.67 -24.73 62.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -177.4 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -51.61 62.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.817 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.565 ' HB3' ' CE2' ' A' ' 38' ' ' PHE . 7.1 m-85 -80.83 -40.89 24.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.889 0.852 . . . . 0.0 109.564 177.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -62.58 -12.97 26.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.285 -179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.381 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.463 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.0 p . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.942 0.401 . . . . 0.0 111.106 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.543 HG22 ' HA ' ' A' ' 72' ' ' ASP . 9.3 p -148.23 -179.38 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.692 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -138.97 -161.12 1.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.953 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.622 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -136.66 132.37 34.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.691 0.281 . . . . 0.0 110.398 178.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -40.64 41.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.512 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.713 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.17 -41.45 61.46 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.534 179.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 2.0 mt-10 -58.91 -32.36 69.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.079 0.466 . . . . 0.0 109.782 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.719 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -69.09 -26.88 65.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.385 179.295 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.713 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.61 -59.2 5.18 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.613 0.721 . . . . 0.0 111.191 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.452 ' O ' HG22 ' A' ' 41' ' ' THR . 14.6 m -60.16 -45.14 94.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.204 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.63 ' HE2' HD11 ' A' ' 30' ' ' LEU . 2.6 m-30 -57.8 -26.71 62.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.608 ' HG2' HG21 ' A' ' 47' ' ' THR . 2.7 ttm -78.24 -56.12 4.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.89 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -57.55 -19.69 27.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.025 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.959 HG23 ' HG2' ' A' ' 42' ' ' GLU . 10.8 t -96.68 -30.76 13.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.959 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -127.46 -37.5 2.0 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -177.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' B' ' 10' ' ' ILE . 7.9 mt -106.85 35.25 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.24 0.543 . . . . 0.0 110.256 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -77.11 -28.61 54.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.745 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.15 -27.46 33.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.74 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CZ ' ' CD2' ' A' ' 88' ' ' HIS . 3.5 m-85 -86.46 -28.23 23.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.591 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.608 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.7 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.212 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' ' 86' ' ' ALA . 53.3 t . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.871 0.367 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 56' ' ' LEU . 6.6 tt -66.82 -51.96 49.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.664 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -26.85 47.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.036 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.9 -52.95 63.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.915 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.879 ' CE ' HD21 ' A' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.54 55.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.915 0.388 . . . . 0.0 111.002 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.527 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.518 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.537 HE21 ' HA ' ' A' ' 70' ' ' GLN . 1.7 mm-40 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.753 0.311 . . . . 0.0 111.423 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -64.6 -133.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.543 ' HA ' HG22 ' A' ' 29' ' ' THR . 1.7 t0 175.46 -169.51 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 118.801 0.728 . . . . 0.0 111.49 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.831 ' CD2' HG21 ' B' ' 85' ' ' VAL . 38.4 p90 -73.69 -58.86 3.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.469 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.482 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -80.05 -25.49 40.11 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.175 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.879 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -44.88 -32.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 t80 -80.12 -54.07 6.11 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.572 178.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' B' ' 77' ' ' LEU . 7.1 mt -56.97 -33.52 67.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.979 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.474 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -75.09 -42.01 57.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.786 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.2 mp -65.92 -57.3 8.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.132 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.888 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.13 -44.5 64.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.948 179.316 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.73 -50.24 50.36 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.145 -1.026 . . . . 0.0 110.731 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.63 -40.1 47.28 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.362 -0.923 . . . . 0.0 111.551 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.879 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.9 mt -59.17 -46.36 88.6 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.892 0.377 . . . . 0.0 110.353 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.725 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.5 -33.65 63.92 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 111.291 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -82.65 -17.07 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.282 -179.476 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.828 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -116.78 11.86 14.65 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.878 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.433 ' N ' HG22 ' A' ' 92' ' ' VAL . 18.6 t -152.75 -39.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.0 OUTLIER -89.82 -85.27 0.21 Allowed 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.82 -179.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -133.15 177.19 7.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.734 0.302 . . . . 0.0 111.079 -179.395 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 70.7 m 60.9 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.631 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 76.25 -49.45 0.59 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.247 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.433 HG22 ' N ' ' A' ' 87' ' ' CYS . 35.9 t . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 121.078 0.466 . . . . 0.0 111.575 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.461 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 121.572 0.701 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.85 -49.06 11.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.415 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.934 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.22 -41.67 96.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 110.128 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.0 OUTLIER -51.47 -31.44 23.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.695 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -28.31 40.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.588 ' HB2' HD22 ' A' ' 13' ' ' LEU . 4.3 p -73.95 -40.64 62.91 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.421 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.137 HG22 HD11 ' B' ' 14' ' ' ILE . 2.5 mp -66.77 -56.31 14.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.895 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.4 OUTLIER -52.13 -27.34 13.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.571 ' O ' HG13 ' B' ' 16' ' ' VAL . 5.9 m -72.12 -56.11 6.15 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.83 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -64.75 -27.69 69.07 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.137 HD11 HG22 ' B' ' 10' ' ' ILE . 13.0 mt -68.99 -37.42 77.2 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.78 0 CA-C-O 121.539 0.685 . . . . 0.0 110.608 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . 0.615 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -76.42 -39.66 52.92 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 113.962 -1.472 . . . . 0.0 112.442 -176.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.83 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.2 m -50.91 -33.97 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.509 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 1.3 t80 -80.5 -59.06 2.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 114.207 -1.36 . . . . 0.0 113.211 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.7 -24.73 62.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.38 -51.61 61.97 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.88 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.558 ' HB3' ' CE2' ' B' ' 38' ' ' PHE . 7.1 m-85 -80.78 -40.95 24.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.842 0.829 . . . . 0.0 109.564 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -62.58 -12.94 25.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.158 -1.383 . . . . 0.0 112.327 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.495 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.58 ' O ' HG13 ' B' ' 28' ' ' VAL . 10.9 p . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 121.007 0.432 . . . . 0.0 111.127 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.525 HG22 ' HA ' ' B' ' 72' ' ' ASP . 9.5 p -148.18 -179.42 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.906 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.688 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -138.95 -161.07 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.019 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.625 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -136.68 132.32 34.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.783 0.325 . . . . 0.0 110.359 178.809 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.65 -40.71 40.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.951 0.405 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.715 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.06 -41.53 61.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.538 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' B' ' 38' ' ' PHE . 2.0 mt-10 -58.96 -32.36 69.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 109.786 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.705 ' HD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -69.07 -26.81 65.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.446 179.237 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.6 -59.26 5.09 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.455 ' O ' HG22 ' B' ' 41' ' ' THR . 14.6 m -60.04 -45.19 93.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.206 -178.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.638 ' HE2' HD11 ' B' ' 30' ' ' LEU . 2.5 m-30 -57.8 -26.75 62.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.973 0.416 . . . . 0.0 110.729 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.619 ' HG2' HG21 ' B' ' 47' ' ' THR . 2.7 ttm -78.22 -56.15 4.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.916 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -57.58 -19.61 26.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.071 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.978 HG23 ' HG2' ' B' ' 42' ' ' GLU . 10.7 t -96.73 -30.81 13.0 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.978 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -127.38 -37.46 2.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 10' ' ' ILE . 7.9 mt -106.93 35.41 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.268 0.556 . . . . 0.0 110.234 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -77.18 -28.6 54.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.777 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.11 -27.5 33.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.76 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.423 ' CZ ' ' CD2' ' B' ' 88' ' ' HIS . 3.5 m-85 -86.41 -28.31 23.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.659 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.619 HG21 ' HG2' ' B' ' 39' ' ' MET . 29.7 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.142 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.827 HG22 ' HB1' ' B' ' 86' ' ' ALA . 53.7 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.881 0.372 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.676 HD23 ' C ' ' B' ' 56' ' ' LEU . 6.6 tt -66.72 -51.98 49.74 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.662 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -26.82 47.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.069 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.83 -52.94 63.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.978 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.906 ' HE2' HD21 ' B' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.52 55.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.027 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.524 ' N ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.567 -179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.539 ' HA ' HE21 ' B' ' 70' ' ' GLN . 1.7 mm-40 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.683 0.278 . . . . 0.0 111.407 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.861 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -64.46 -133.62 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.525 ' HA ' HG22 ' B' ' 29' ' ' THR . 1.7 t0 175.43 -169.55 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 118.805 0.73 . . . . 0.0 111.458 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 38.6 p90 -73.61 -58.88 3.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.509 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.485 HE22 ' HB2' ' B' ' 78' ' ' ASN . 0.2 OUTLIER -80.06 -25.5 40.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.104 179.408 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.861 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.2 OUTLIER -44.93 -32.63 1.68 Allowed 'General case' 0 CA--C 1.522 -0.115 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.438 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.565 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 t80 -80.2 -54.01 6.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.555 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' A' ' 77' ' ' LEU . 7.1 mt -56.97 -33.63 67.27 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.902 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.485 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -74.95 -42.07 58.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.257 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.792 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.2 mp -65.95 -57.2 8.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.129 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.896 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.21 -44.57 64.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.923 179.353 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.6 -50.3 49.29 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.17 -1.014 . . . . 0.0 110.761 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.561 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.63 -40.07 47.23 Favored Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.231 -0.985 . . . . 0.0 111.618 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.906 HD21 ' HE2' ' B' ' 59' ' ' MET . 7.0 mt -59.16 -46.39 88.5 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.828 0.347 . . . . 0.0 110.264 178.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.717 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.44 -33.76 63.89 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.23 0.538 . . . . 0.0 111.209 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.831 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -82.64 -17.1 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.235 -179.351 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -116.85 11.97 14.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.863 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.435 ' N ' HG22 ' B' ' 92' ' ' VAL . 18.7 t -152.78 -39.46 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.103 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.0 OUTLIER -89.8 -85.24 0.21 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.856 -179.196 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' B' ' 85' ' ' VAL . 0.1 OUTLIER -133.04 177.22 7.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.749 0.309 . . . . 0.0 111.079 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' B' ' 91' ' ' PHE . 70.5 m 60.87 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.655 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' B' ' 90' ' ' SER . 0.1 OUTLIER 76.19 -49.48 0.59 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.226 -179.739 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.435 HG22 ' N ' ' B' ' 87' ' ' CYS . 36.0 t . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 121.288 0.566 . . . . 0.0 111.03 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.43 -44.24 8.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.321 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.863 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.3 m -71.63 -38.18 70.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.363 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.7 OUTLIER -52.49 -53.33 47.17 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.969 0.414 . . . . 0.0 110.445 179.772 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.08 -26.65 62.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.584 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.573 ' HB3' HD22 ' B' ' 13' ' ' LEU . 74.2 m -74.67 -54.42 7.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.569 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 2.2 mp -54.7 -56.5 10.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.847 0.356 . . . . 0.0 111.574 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.951 ' HA ' HD12 ' A' ' 14' ' ' ILE . 1.8 mt-10 -52.32 -27.46 15.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.847 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -62.88 -55.72 23.59 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.196 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.979 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -74.79 -27.83 60.47 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 6.6 mt -67.2 -35.93 75.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 O-C-N 121.648 -0.657 . . . . 0.0 110.925 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.94 -32.7 45.6 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.455 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.2 m -52.67 -35.83 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 176.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 3.1 t80 -78.02 -59.01 2.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.032 -1.44 . . . . 0.0 110.634 179.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.773 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 3.8 mm-40 -49.61 -45.69 48.38 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -47.91 -51.58 22.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.646 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.4 m-85 -81.17 -31.89 33.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.672 0.749 . . . . 0.0 110.289 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -86.72 20.13 2.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.0 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.303 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.612 0.244 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.49 HG22 ' HA ' ' A' ' 72' ' ' ASP . 3.3 p -140.69 153.13 45.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.137 0.494 . . . . 0.0 111.536 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.663 HD12 ' HE2' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.17 0.51 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.956 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.502 ' H ' HD13 ' A' ' 30' ' ' LEU . 14.0 t -145.25 138.05 26.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.758 0.314 . . . . 0.0 110.455 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.81 -35.85 24.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.813 -179.719 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.703 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.35 -42.85 58.68 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.441 179.484 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -55.92 -29.03 59.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 110.035 179.676 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.581 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -72.21 -32.56 66.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.057 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.703 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -50.02 -59.13 4.19 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.654 0.74 . . . . 0.0 110.913 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.734 ' O ' HG22 ' A' ' 41' ' ' THR . 0.2 OUTLIER -63.79 -44.27 93.87 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.7 -179.141 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 20' ' ' TYR . 32.0 t80 -58.01 -29.64 65.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.821 ' HG2' HG21 ' A' ' 47' ' ' THR . 1.1 ttm -78.08 -46.61 20.34 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.47 -19.74 63.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.028 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.816 HG23 ' HG2' ' A' ' 42' ' ' GLU . 5.9 t -94.35 -35.44 12.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.816 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -128.78 20.23 6.03 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.5 HD21 HD11 ' B' ' 10' ' ' ILE . 13.7 mt -161.84 44.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.349 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.52 -23.93 56.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.87 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.68 -14.13 62.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.229 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.458 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.2 m-85 -110.97 11.08 22.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.355 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.821 HG21 ' HG2' ' A' ' 39' ' ' MET . 30.0 p . . . . . 0 C--N 1.331 -0.211 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 1.6 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.179 0.514 . . . . 0.0 110.844 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.02 -52.01 12.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.908 -179.457 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.817 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.4 t0 -56.45 -29.28 61.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.264 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -52.2 66.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.252 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.897 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.9 ptp -54.95 -52.85 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.927 0.394 . . . . 0.0 111.175 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.5 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.286 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.481 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.878 0.371 . . . . 0.0 111.376 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.896 HD13 ' HG2' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -66.41 -139.02 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.255 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.511 ' C ' ' OE1' ' A' ' 75' ' ' GLU . 4.4 p-10 172.48 -157.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.347 0.521 . . . . 0.0 111.777 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.809 ' CD2' HG21 ' B' ' 85' ' ' VAL . 29.7 p90 -84.46 -59.93 2.23 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.524 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.9 tp60 -76.98 -35.13 57.42 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -177.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.896 ' HG2' HD13 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -49.22 -26.53 2.98 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.005 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.663 ' HE2' HD12 ' A' ' 30' ' ' LEU . 1.1 t80 -77.33 -54.05 6.94 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' B' ' 77' ' ' LEU . 8.0 mt -57.79 -33.56 68.69 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.401 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.3 OUTLIER -76.68 -43.35 38.15 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.681 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.837 HD13 ' O ' ' A' ' 75' ' ' GLU . 2.7 mp -58.08 -57.57 12.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.782 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.962 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.93 -44.17 28.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.061 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.17 51.33 Favored Glycine 0 CA--C 1.508 -0.363 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.732 179.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.29 -41.13 46.89 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.147 -1.025 . . . . 0.0 111.394 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.897 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.6 mt -57.91 -46.8 84.42 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.623 -0.339 . . . . 0.0 110.466 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.441 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.57 -31.95 62.62 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.051 0.453 . . . . 0.0 111.058 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.818 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.17 -17.6 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.512 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -114.03 14.16 18.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.134 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.458 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -156.19 -37.72 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.347 179.636 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.1 t60 -91.11 157.99 16.91 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.891 0.377 . . . . 0.0 111.081 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 93.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.052 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.3 m -150.29 -67.8 0.2 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.601 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.604 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -121.05 -32.54 3.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.01 179.722 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.454 HG13 ' HA ' ' A' ' 86' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.471 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.733 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.265 0 CA-C-O 121.36 0.6 . . . . 0.0 110.964 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.45 -44.22 8.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.376 -179.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.851 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.6 m -71.75 -38.03 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.35 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.733 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.7 OUTLIER -52.45 -53.36 46.52 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.915 0.388 . . . . 0.0 110.461 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.12 -26.66 62.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.574 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 13' ' ' LEU . 74.2 m -74.59 -54.41 7.52 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.604 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.078 HG22 HD11 ' B' ' 14' ' ' ILE . 2.2 mp -54.72 -56.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 111.615 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.968 ' HA ' HD12 ' B' ' 14' ' ' ILE . 1.8 mt-10 -52.38 -27.34 15.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -63.02 -55.74 23.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.978 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -74.7 -27.83 60.56 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.078 HD11 HG22 ' B' ' 10' ' ' ILE . 6.7 mt -67.22 -35.93 75.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 121.612 -0.68 . . . . 0.0 110.859 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.09 -32.6 44.74 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.459 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.978 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.2 m -52.57 -35.97 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 176.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.566 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.1 t80 -77.92 -59.03 2.95 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 113.923 -1.489 . . . . 0.0 110.683 179.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 3.8 mm-40 -49.68 -45.65 49.02 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -47.79 -51.72 21.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.614 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.525 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.4 m-85 -81.11 -31.91 34.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.627 0.727 . . . . 0.0 110.294 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.485 ' HA ' HD23 ' B' ' 30' ' ' LEU . . . -86.74 20.12 2.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.931 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.421 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.324 179.925 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.633 0.254 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.486 HG22 ' HA ' ' B' ' 72' ' ' ASP . 3.3 p -140.69 153.19 45.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.291 0.567 . . . . 0.0 111.417 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.661 HD12 ' HE2' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.19 0.51 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.956 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.494 ' H ' HD13 ' B' ' 30' ' ' LEU . 13.9 t -145.28 138.03 26.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.306 . . . . 0.0 110.462 179.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.77 -35.92 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.776 -179.694 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.702 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.22 -42.94 58.95 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.456 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.1 OUTLIER -55.94 -28.96 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.059 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.569 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -72.26 -32.61 66.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.028 178.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -49.96 -59.07 4.23 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.594 0.712 . . . . 0.0 110.863 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.755 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -63.97 -44.09 93.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.631 -178.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.449 ' HB2' ' CZ ' ' B' ' 20' ' ' TYR . 31.9 t80 -58.16 -29.65 65.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.831 ' HG2' HG21 ' B' ' 47' ' ' THR . 1.1 ttm -78.03 -46.64 20.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.946 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.51 -19.63 63.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.082 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.811 HG23 ' HG2' ' B' ' 42' ' ' GLU . 5.9 t -94.45 -35.32 12.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.811 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.1 OUTLIER -128.86 20.3 5.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.804 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.482 HD21 HD11 ' A' ' 10' ' ' ILE . 13.7 mt -161.85 44.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.036 0.446 . . . . 0.0 110.413 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.44 -24.09 57.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.814 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.67 -13.98 62.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.246 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.1 m-85 -111.03 11.12 22.09 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.419 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.831 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.641 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 1.6 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.154 0.502 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.807 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.03 -51.91 12.39 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.944 -179.434 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.807 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.4 t0 -56.56 -29.27 61.81 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.282 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -52.19 66.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.245 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.938 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.9 ptp -54.89 -52.9 61.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 111.236 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.493 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.36 -179.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.471 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.97 0.414 . . . . 0.0 111.324 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.847 HD13 ' HG2' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -66.36 -139.02 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.212 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.504 ' C ' ' OE1' ' B' ' 75' ' ' GLU . 4.4 p-10 172.47 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.383 0.538 . . . . 0.0 111.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CG ' HG11 ' A' ' 85' ' ' VAL . 29.7 p90 -84.45 -59.92 2.23 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -178.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.51 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.8 tp60 -76.94 -35.11 57.51 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.847 ' HG2' HD13 ' B' ' 71' ' ' LEU . 0.8 OUTLIER -49.25 -26.63 3.11 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.925 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.661 ' HE2' HD12 ' B' ' 30' ' ' LEU . 1.1 t80 -77.25 -54.08 6.93 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' A' ' 77' ' ' LEU . 8.0 mt -57.77 -33.51 68.58 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.403 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.3 OUTLIER -76.71 -43.35 37.88 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.829 HD13 ' O ' ' B' ' 75' ' ' GLU . 2.7 mp -58.2 -57.46 12.78 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.796 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 1.0 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.92 -44.18 28.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.09 179.406 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -50.11 51.66 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.178 -1.01 . . . . 0.0 110.747 179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.32 -41.16 47.18 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.375 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.938 HD21 ' HE2' ' B' ' 59' ' ' MET . 6.4 mt -57.87 -46.85 84.23 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.438 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.47 -31.98 62.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.143 0.497 . . . . 0.0 111.205 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.809 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.15 -17.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.586 -179.469 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.641 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -113.96 14.01 18.37 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.162 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.448 ' HB3' ' CD2' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -156.12 -37.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.321 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.1 t60 -91.02 157.98 16.95 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.879 0.371 . . . . 0.0 111.118 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.38 93.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.975 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.6 m -150.43 -67.69 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.612 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -121.11 -32.59 3.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.96 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.444 HG13 ' HA ' ' B' ' 86' ' ' ALA . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.53 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.77 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.52 -0.184 0 CA-C-O 121.476 0.655 . . . . 0.0 111.702 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.48 -48.97 37.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.755 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.941 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.4 m -60.49 -37.57 81.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.078 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.77 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.7 -36.64 47.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.46 -26.96 41.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.342 178.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -65.37 -45.31 84.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.288 -179.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.134 HG22 HD11 ' A' ' 14' ' ' ILE . 3.2 mp -63.05 -56.77 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.46 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.72 -179.455 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.74 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.871 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.929 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -71.97 -27.22 62.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.134 HD11 HG22 ' A' ' 10' ' ' ILE . 7.8 mt -66.9 -36.02 76.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.944 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.75 -35.67 60.11 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.35 -1.296 . . . . 0.0 112.473 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.929 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.9 m -56.82 -35.68 47.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.479 0.657 . . . . 0.0 109.742 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 14.6 t80 -80.22 -59.91 2.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.757 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.905 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.51 -29.63 69.77 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.335 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.43 -51.68 52.71 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.323 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.523 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.0 m-85 -80.35 -40.03 27.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.69 0.757 . . . . 0.0 109.538 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.905 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.89 -24.47 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.608 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.443 -179.921 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.458 -0.061 0 CA-C-O 120.912 0.386 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.718 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 20.8 p -136.4 -177.45 4.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.71 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -129.68 -128.24 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.632 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.631 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -170.97 130.47 0.79 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.409 ' CE ' ' HG2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.33 43.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.944 0.402 . . . . 0.0 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.695 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.33 -43.42 56.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.482 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.7 mt-10 -55.82 -29.15 59.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.01 0.433 . . . . 0.0 110.428 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.509 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 6.8 t80 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.371 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.695 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.76 -59.04 5.61 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.686 0.755 . . . . 0.0 111.3 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.891 ' O ' HG22 ' A' ' 41' ' ' THR . 0.7 OUTLIER -58.24 -32.52 68.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.274 -178.488 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -57.78 -38.18 75.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.696 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -74.61 -35.4 62.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.201 0.524 . . . . 0.0 110.338 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -73.27 -19.25 61.1 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.46 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 37' ' ' SER . 3.7 t -107.65 -43.57 4.47 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -178.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.62 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.2 mm-40 -127.85 -18.42 4.26 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -176.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 10' ' ' ILE . 9.4 mt -120.27 49.56 1.41 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.273 0.559 . . . . 0.0 110.183 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -82.93 -29.37 29.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.926 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.75 30.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.59 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 87' ' ' CYS . 47.8 m-85 -95.79 20.48 9.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.745 -179.934 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 86' ' ' ALA . 53.9 t . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.724 0.297 . . . . 0.0 111.392 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -76.51 -52.57 9.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.066 0.46 . . . . 0.0 112.017 -179.491 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.822 ' N ' HD23 ' A' ' 56' ' ' LEU . 10.2 t0 -55.38 -59.08 5.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.196 -178.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.8 -35.59 73.09 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.832 ' HE2' HD21 ' A' ' 83' ' ' LEU . 3.2 tmm? -75.51 -43.78 47.18 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 120.426 0.155 . . . . 0.0 111.413 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.483 ' HG3' ' CD1' ' A' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.856 0.36 . . . . 0.0 110.443 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.432 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.697 0.284 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -65.0 -137.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 22.9 t70 171.78 161.24 0.1 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.436 0.562 . . . . 0.0 111.492 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.941 ' CG ' HG11 ' B' ' 85' ' ' VAL . 35.9 p90 -52.14 -59.77 3.99 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.644 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.526 HE22 ' HB2' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -79.66 -22.9 42.94 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.261 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.942 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.4 tt0 -45.41 -43.68 11.45 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.6 t80 -71.32 -54.41 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.301 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.472 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -51.19 -38.56 52.99 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.183 0.516 . . . . 0.0 109.74 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.526 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -36.72 57.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.494 -0.776 . . . . 0.0 108.991 178.028 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.27 -57.54 8.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.288 -179.514 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.89 -43.84 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 178.636 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.45 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -54.2 -50.99 53.68 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.65 179.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.58 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.05 -41.64 60.27 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.867 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.832 HD21 ' HE2' ' A' ' 59' ' ' MET . 3.3 mt -61.86 -42.26 98.84 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -54.42 -32.43 57.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.374 0.607 . . . . 0.0 110.188 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.932 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.67 -17.78 9.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.553 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.494 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.87 14.5 19.81 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.143 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 46' ' ' PHE . 52.8 t -157.94 -42.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.926 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.413 ' ND1' HD13 ' B' ' 14' ' ' ILE . 15.0 t-80 -90.31 162.93 14.95 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.872 0.368 . . . . 0.0 110.963 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.18 112.64 1.79 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.081 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.65 -53.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.808 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -127.39 -45.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.691 179.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.486 HG11 ' C ' ' A' ' 86' ' ' ALA . 30.8 m . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.761 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.475 0.655 . . . . 0.0 111.713 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.37 -49.07 36.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.752 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.912 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.4 m -60.44 -37.55 81.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.089 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.761 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -36.69 48.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.008 0.432 . . . . 0.0 110.274 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -26.95 42.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.413 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.47 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.5 OUTLIER -65.44 -45.3 84.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.227 -179.664 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' B' ' 14' ' ' ILE . 3.2 mp -63.1 -56.75 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.434 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.702 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.508 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.86 13.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.928 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -71.92 -27.16 62.64 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' B' ' 10' ' ' ILE . 7.8 mt -66.92 -36.04 76.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 O-C-N 121.751 -0.593 . . . . 0.0 110.998 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.76 60.36 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 112.474 -176.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.928 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.1 m -56.85 -35.63 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.458 0.647 . . . . 0.0 109.748 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.511 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 14.8 t80 -80.16 -59.98 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.737 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.3 OUTLIER -66.44 -29.68 69.87 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.47 -51.68 52.96 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.318 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.52 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.0 m-85 -80.3 -39.99 27.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.708 0.766 . . . . 0.0 109.66 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.883 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -56.91 -24.41 52.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.623 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.459 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.403 HG13 ' N ' ' B' ' 29' ' ' THR . 13.9 p . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.913 0.387 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.722 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 20.6 p -136.4 -177.39 4.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.609 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.689 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -129.67 -128.24 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.61 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.624 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -170.96 130.5 0.79 Allowed 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.404 ' CE ' ' HG2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.31 43.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.017 -179.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.36 -43.33 57.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.997 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.474 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.7 mt-10 -55.99 -29.02 59.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.079 0.466 . . . . 0.0 110.425 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 6.9 t80 -72.77 -27.0 61.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.289 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.64 -59.02 5.62 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.597 0.713 . . . . 0.0 111.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.87 ' O ' HG22 ' B' ' 41' ' ' THR . 0.7 OUTLIER -58.23 -32.51 68.39 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.303 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.78 -38.2 75.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.693 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -74.65 -35.33 62.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.154 0.502 . . . . 0.0 110.326 179.459 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -73.28 -19.17 61.11 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.476 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.87 HG22 ' O ' ' B' ' 37' ' ' SER . 3.7 t -107.61 -43.71 4.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.2 mm-40 -127.76 -18.53 4.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -176.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.724 HD21 HD11 ' A' ' 10' ' ' ILE . 9.4 mt -120.14 49.51 1.4 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.312 0.577 . . . . 0.0 110.304 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -82.94 -29.3 29.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.919 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.74 30.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.57 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.415 ' CD1' ' HB3' ' B' ' 87' ' ' CYS . 47.4 m-85 -95.86 20.52 9.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.725 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.7 t . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.709 -179.915 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.486 HG13 ' HB3' ' B' ' 86' ' ' ALA . 54.2 t . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.7 0.286 . . . . 0.0 111.377 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.834 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -76.49 -52.59 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.056 0.455 . . . . 0.0 112.03 -179.532 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . 0.834 ' N ' HD23 ' B' ' 56' ' ' LEU . 10.2 t0 -55.34 -59.07 5.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.273 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 7.6 mmt180 -58.8 -35.68 73.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.838 ' HE2' HD21 ' B' ' 83' ' ' LEU . 3.2 tmm? -75.38 -43.88 47.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.436 0.16 . . . . 0.0 111.41 -179.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.481 ' HG3' ' CD1' ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 120.858 0.361 . . . . 0.0 110.428 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.703 0.287 . . . . 0.0 110.868 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -65.1 -138.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.591 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 22.8 t70 171.78 161.3 0.1 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.453 0.569 . . . . 0.0 111.462 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.932 ' CG ' HG11 ' A' ' 85' ' ' VAL . 35.6 p90 -52.16 -59.79 3.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.626 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.53 HE22 ' HB2' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -79.69 -22.91 42.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.16 -179.32 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.945 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.4 tt0 -45.42 -43.7 11.49 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.53 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.6 t80 -71.3 -54.39 10.99 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.356 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.47 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.3 mt -51.21 -38.65 53.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.195 0.521 . . . . 0.0 109.667 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.53 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.37 -36.58 58.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.049 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.945 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.36 -57.63 7.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.264 -179.564 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.71 -43.82 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.419 178.619 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.453 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -54.13 -51.0 53.35 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.141 -1.028 . . . . 0.0 110.705 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.582 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.07 -41.64 60.46 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.895 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.838 HD21 ' HE2' ' B' ' 59' ' ' MET . 3.4 mt -61.91 -42.28 98.91 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.27 -32.53 56.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.941 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.621 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.486 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.01 14.58 19.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.077 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.415 ' HB3' ' CD1' ' B' ' 46' ' ' PHE . 52.9 t -158.03 -42.27 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.404 ' ND1' HD13 ' A' ' 14' ' ' ILE . 14.8 t-80 -90.32 162.93 14.94 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.821 0.343 . . . . 0.0 110.972 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.21 112.61 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.67 -53.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.847 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -127.54 -45.58 1.48 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.711 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.479 HG11 ' C ' ' B' ' 86' ' ' ALA . 30.9 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.137 0 CA-C-O 121.351 0.596 . . . . 0.0 111.156 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.96 -49.07 11.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.998 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.965 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.6 OUTLIER -62.55 -40.42 96.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.087 179.121 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.1 -36.64 41.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.633 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.67 -26.89 40.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.707 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.627 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.6 p -66.86 -42.2 86.08 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.513 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.04 HG22 HD11 ' A' ' 14' ' ' ILE . 3.5 mp -70.98 -54.65 16.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.776 0.322 . . . . 0.0 111.682 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.973 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.94 -27.28 12.63 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -178.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.622 ' O ' HG13 ' A' ' 16' ' ' VAL . 16.6 m -75.73 -55.87 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.777 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.808 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.8 mm? -58.82 -27.06 64.72 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.04 HD11 HG22 ' A' ' 10' ' ' ILE . 8.8 mt -73.54 -38.67 52.85 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 CA-C-O 121.489 0.661 . . . . 0.0 110.357 178.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 19' ' ' LYS . . . -73.63 -37.15 65.46 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.787 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -56.81 -36.29 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-O 121.463 0.649 . . . . 0.0 109.815 178.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.499 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 4.2 t80 -79.81 -59.92 2.55 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.664 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.5 OUTLIER -64.42 -39.45 93.86 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 11.7 tppt? -47.89 -50.69 25.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.812 0.339 . . . . 0.0 110.817 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -79.35 -39.83 31.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.769 0.795 . . . . 0.0 109.344 178.464 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.819 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.36 -19.02 43.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.24 -1.345 . . . . 0.0 112.063 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.627 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.433 ' O ' ' OG1' ' A' ' 29' ' ' THR . 28.5 t . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.789 0.328 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 28' ' ' VAL . 3.5 p 56.33 154.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.817 -0.628 . . . . 0.0 111.375 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.62 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -101.99 -128.9 0.23 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.27 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.472 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -171.81 123.79 0.53 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.391 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -49.68 -36.33 24.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.128 -179.244 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.21 -42.0 60.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.646 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.38 -28.59 68.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.114 0.483 . . . . 0.0 109.963 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -72.05 -31.62 66.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.958 179.166 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -50.87 -59.17 4.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.683 0.754 . . . . 0.0 111.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -55.18 28.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.446 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.51 ' CD2' ' CG ' ' A' ' 20' ' ' TYR . 21.2 m-85 -57.91 -35.6 71.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.166 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.622 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.1 OUTLIER -72.61 -27.6 62.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.602 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.802 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 25.6 m-20 -73.71 -19.6 60.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.719 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.49 -80.74 0.58 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.669 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.39 -30.66 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.781 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.556 HD21 HD11 ' B' ' 10' ' ' ILE . 30.5 mt -133.64 51.67 2.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.004 0.43 . . . . 0.0 110.761 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.802 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -78.78 -41.49 30.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.884 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.87 24.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.245 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -82.6 -40.53 20.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.622 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.9 p . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.807 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 86' ' ' ALA . 34.6 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.771 0.32 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.61 ' O ' ' HG2' ' A' ' 59' ' ' MET . 10.8 tp -68.69 -45.11 72.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.557 0.694 . . . . 0.0 110.465 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.6 -26.51 44.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.846 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.14 -53.67 10.43 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.471 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.954 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -55.92 -53.79 52.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.004 0.431 . . . . 0.0 111.633 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.517 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.083 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 120.762 0.315 . . . . 0.0 110.488 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.737 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -70.39 -138.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.136 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.512 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.5 OUTLIER 172.39 179.04 0.08 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 118.516 0.598 . . . . 0.0 111.715 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.2 p90 -64.78 -57.65 8.35 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.336 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -78.81 -20.99 48.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.076 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -45.1 -36.86 3.87 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 35' ' ' PHE . 2.9 t80 -80.2 -54.24 5.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.799 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -51.83 -34.09 38.9 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.175 0.512 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.44 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.41 -48.99 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.223 178.009 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.834 HD13 ' O ' ' A' ' 75' ' ' GLU . 5.3 mp -59.78 -58.19 9.65 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.868 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.786 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -71.24 -46.46 65.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.843 179.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.552 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.84 -50.35 50.53 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.102 -1.047 . . . . 0.0 110.525 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.462 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -52.11 -32.79 36.29 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.583 178.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.954 HD21 ' HE3' ' A' ' 59' ' ' MET . 14.1 mt -64.48 -46.6 82.32 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 120.901 0.381 . . . . 0.0 110.12 179.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.571 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.09 -32.87 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.625 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.905 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.6 9.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.403 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.94 12.75 14.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.671 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.491 ' N ' ' O ' ' A' ' 83' ' ' LEU . 53.6 t -152.45 -43.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.879 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -84.11 148.82 26.59 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.75 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.36 85.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.213 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' PHE . 41.0 p -179.59 102.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.744 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.575 ' CB ' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 82.85 -30.13 0.09 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.8 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 85' ' ' VAL . 60.4 t . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.715 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.179 0 CA-C-O 121.478 0.656 . . . . 0.0 111.145 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -49.11 11.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.998 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.977 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.6 OUTLIER -62.44 -40.44 96.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.025 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.16 -36.58 41.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.61 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.77 -26.88 40.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.66 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -66.79 -42.26 86.28 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.519 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 0.989 HG22 HD11 ' B' ' 14' ' ' ILE . 3.5 mp -71.04 -54.63 16.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.597 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.992 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.01 -27.27 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.529 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' B' ' 16' ' ' VAL . 16.6 m -75.67 -55.83 5.27 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.909 -0.317 . . . . 0.0 111.833 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 0.814 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -58.83 -27.17 64.85 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' B' ' 11' ' ' GLU . 8.8 mt -73.44 -38.73 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 CA-C-O 121.433 0.635 . . . . 0.0 110.34 178.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' B' ' 19' ' ' LYS . . . -73.62 -37.1 65.49 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.824 -177.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.814 HG22 ' O ' ' B' ' 13' ' ' LEU . 18.8 m -56.85 -36.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.429 0.633 . . . . 0.0 109.81 178.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.497 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 4.2 t80 -79.8 -60.03 2.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.661 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.5 OUTLIER -64.34 -39.48 93.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.602 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' B' ' 15' ' ' ALA . 11.7 tppt? -47.9 -50.68 25.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.852 0.358 . . . . 0.0 110.888 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.518 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -79.25 -39.88 31.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.8 0.81 . . . . 0.0 109.335 178.404 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.842 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.45 -19.04 44.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.985 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.411 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.663 -179.927 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . 0.407 ' O ' ' OG1' ' B' ' 29' ' ' THR . 28.8 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.701 0.286 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' B' ' 28' ' ' VAL . 3.7 p 56.39 154.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.392 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.591 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -102.02 -128.91 0.23 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.255 -179.846 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.479 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -171.76 123.83 0.54 Allowed 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.457 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.0 OUTLIER -49.64 -36.38 24.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.087 -179.207 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.16 -42.11 60.45 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.28 -28.69 68.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 109.925 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -71.95 -31.72 66.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.207 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -50.81 -59.26 4.29 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.588 0.709 . . . . 0.0 111.49 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -55.14 29.45 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.578 -1.192 . . . . 0.0 111.527 -178.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.517 ' CD2' ' CG ' ' B' ' 20' ' ' TYR . 21.1 m-85 -57.87 -35.65 71.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.146 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.614 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.1 OUTLIER -72.63 -27.61 62.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.541 179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.788 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 25.6 m-20 -73.62 -19.7 60.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.7 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.37 -80.93 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.668 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.28 -30.6 3.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.848 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.553 HD21 HD11 ' A' ' 10' ' ' ILE . 30.3 mt -133.74 51.65 2.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.813 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.788 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -78.74 -41.53 30.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.835 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.8 23.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -82.73 -40.52 20.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.614 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 86' ' ' ALA . 34.1 t . . . . . 0 N--CA 1.462 0.13 0 CA-C-O 120.696 0.284 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.6 ' O ' ' HG2' ' B' ' 59' ' ' MET . 10.7 tp -68.66 -45.11 72.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.578 0.704 . . . . 0.0 110.502 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -55.49 -26.6 43.56 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.856 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.21 -53.65 10.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.387 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.958 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -55.9 -53.79 52.51 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.018 0.437 . . . . 0.0 111.6 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.538 ' HE3' ' HG ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.147 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.406 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 1.5 mm-40 . . . . . 0 N--CA 1.463 0.215 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.732 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -70.41 -138.16 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.209 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.5 OUTLIER 172.38 179.13 0.08 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.463 0.574 . . . . 0.0 111.746 179.723 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.905 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.9 p90 -64.75 -57.73 8.15 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.349 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -78.85 -20.91 48.47 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.027 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.827 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -45.04 -37.01 3.82 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.765 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 3.0 t80 -80.21 -54.16 6.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.792 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' A' ' 77' ' ' LEU . 7.3 mt -51.84 -34.04 38.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.194 0.521 . . . . 0.0 109.733 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.44 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.5 -48.98 17.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.172 178.034 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.827 HD13 ' O ' ' B' ' 75' ' ' GLU . 5.3 mp -59.8 -58.13 9.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.869 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.789 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -71.29 -46.42 65.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.84 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.78 -50.4 49.98 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.126 -1.035 . . . . 0.0 110.555 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.485 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -52.22 -32.69 36.89 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.6 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.958 HD21 ' HE3' ' B' ' 59' ' ' MET . 14.2 mt -64.47 -46.58 82.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.979 0.419 . . . . 0.0 110.134 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.593 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.14 -32.89 62.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.603 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.52 -17.65 9.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.497 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.92 12.94 14.84 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.67 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.494 ' N ' ' O ' ' B' ' 83' ' ' LEU . 53.6 t -152.55 -43.49 0.1 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.495 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.9 OUTLIER -84.22 148.83 26.51 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.764 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.39 85.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' B' ' 91' ' ' PHE . 40.8 p -179.52 102.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.571 ' CB ' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 83.01 -30.15 0.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.765 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 85' ' ' VAL . 60.3 t . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.915 0.388 . . . . 0.0 111.299 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.624 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.52 -0.18 0 CA-C-O 121.375 0.607 . . . . 0.0 111.149 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.02 -40.1 6.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.117 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.956 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.7 m -70.16 -37.43 75.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.233 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.624 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.66 60.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.015 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -77.4 -26.82 52.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.608 ' HB3' HD22 ' B' ' 13' ' ' LEU . 81.8 m -72.29 -51.87 18.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 1.079 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -52.89 -56.24 8.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.6 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 1.031 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.3 OUTLIER -52.36 -27.51 15.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -178.846 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -66.01 -55.71 15.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.038 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -71.19 -27.69 63.69 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.079 HD11 HG22 ' A' ' 10' ' ' ILE . 7.7 mt -67.3 -37.45 79.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.546 0.688 . . . . 0.0 110.882 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.03 -32.88 61.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.376 -176.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.038 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.1 m -52.63 -38.21 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.489 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.6 t80 -77.5 -58.05 3.48 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.529 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.81 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -49.13 -35.8 17.41 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.839 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.1 -52.26 59.19 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.294 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.844 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.8 m-85 -81.28 -47.36 13.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.771 0.796 . . . . 0.0 110.093 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.565 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.89 -21.06 26.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.867 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.401 179.904 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.987 0.423 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.9 p -133.99 172.75 12.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.297 0.57 . . . . 0.0 110.778 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.844 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -114.38 -144.76 0.39 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.527 ' H ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -160.63 138.11 9.38 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.531 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -41.53 44.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.101 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.735 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.91 -45.31 61.68 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.416 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 3.6 mt-10 -57.57 -28.95 64.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.156 0.503 . . . . 0.0 109.97 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.451 ' CE2' ' CB ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -67.49 -32.97 74.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.805 178.709 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.735 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -51.01 -59.2 4.41 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.515 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.613 ' O ' HG22 ' A' ' 41' ' ' THR . 68.8 m -54.09 -48.64 70.46 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.593 -178.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.527 ' HA ' HG22 ' A' ' 41' ' ' THR . 31.8 t80 -57.92 -27.42 63.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.893 0.377 . . . . 0.0 110.966 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.932 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -73.7 -58.25 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.196 -179.809 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.423 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 1.9 p30 -65.38 -19.36 65.91 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.948 HG23 ' HG2' ' A' ' 42' ' ' GLU . 13.3 t -96.08 -31.73 12.88 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.948 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -129.29 14.67 6.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.879 HD12 ' HE2' ' A' ' 39' ' ' MET . 40.2 mt -161.93 41.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 109.692 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.423 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -75.67 -26.24 57.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.86 -7.7 36.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.05 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -112.25 -13.84 13.42 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.621 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.932 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.2 p . . . . . 0 N--CA 1.465 0.294 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.774 HG12 HD22 ' A' ' 83' ' ' LEU . 32.6 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.916 0.389 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.625 ' O ' ' HG3' ' A' ' 59' ' ' MET . 7.0 tp -75.24 -29.54 60.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 111.703 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -76.12 -28.19 57.37 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.643 -178.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.24 -45.21 41.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.697 0.284 . . . . 0.0 111.554 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.886 ' HE2' HD21 ' A' ' 83' ' ' LEU . 0.9 OUTLIER -54.35 -54.32 42.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 112.077 -179.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.658 ' H ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.643 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.517 -179.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.608 0.242 . . . . 0.0 110.768 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 72' ' ' ASP . 0.8 OUTLIER -66.43 -146.79 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.396 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.627 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 1.3 p30 170.79 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.221 0.534 . . . . 0.0 112.127 179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.8 ' CZ ' ' HB1' ' B' ' 84' ' ' ALA . 0.3 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.698 -178.739 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.5 HE21 ' CB ' ' A' ' 78' ' ' ASN . 37.4 tp60 -66.41 -34.01 76.99 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.603 -178.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.919 ' O ' HD23 ' A' ' 79' ' ' LEU . 1.9 tt0 -45.14 -47.09 12.25 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.806 0.336 . . . . 0.0 110.188 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.8 t80 -70.98 -46.45 62.31 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.412 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.702 HD13 ' HA3' ' B' ' 81' ' ' GLY . 7.2 mt -56.81 -40.14 75.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.5 ' CB ' HE21 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -39.51 53.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.056 178.183 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -60.26 -58.22 9.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.526 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.637 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.15 -46.08 45.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.706 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.707 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -54.27 -50.33 56.49 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.405 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.41 -35.53 36.14 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.425 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.886 HD21 ' HE2' ' A' ' 59' ' ' MET . 11.3 mt -61.5 -43.9 98.04 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.88 0.371 . . . . 0.0 110.06 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.787 ' HB1' ' CZ ' ' B' ' 73' ' ' PHE . . . -55.29 -34.22 63.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.324 0.583 . . . . 0.0 110.942 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.17 -17.01 10.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.195 -179.682 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.502 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.16 13.64 15.77 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.764 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.435 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.5 OUTLIER -157.32 -42.87 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.263 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 20.4 m-70 -75.86 147.67 38.9 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.378 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.35 78.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.477 ' CB ' ' CE2' ' B' ' 73' ' ' PHE . 74.9 m -145.99 -53.55 0.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.623 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.674 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -112.96 -44.97 3.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.743 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 85' ' ' VAL . 7.9 m . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.317 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' THR . . . . . 0.629 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.162 0 CA-C-O 121.381 0.61 . . . . 0.0 111.16 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.87 -40.29 6.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.081 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.95 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.6 m -70.07 -37.47 75.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.227 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.629 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.67 61.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.028 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -77.44 -26.81 51.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.635 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB3' HD22 ' A' ' 13' ' ' LEU . 81.7 m -72.34 -51.79 19.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.146 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ILE . . . . . 1.076 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -52.89 -56.26 8.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.653 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.3 OUTLIER -52.34 -27.55 15.85 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.4 OUTLIER -65.89 -55.66 15.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.027 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' LEU . . . . . 1.032 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -71.35 -27.65 63.51 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' ILE . . . . . 1.076 HD11 HG22 ' B' ' 10' ' ' ILE . 7.7 mt -67.31 -37.4 78.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.543 0.687 . . . . 0.0 110.851 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.11 -32.83 61.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.403 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 1.032 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.9 m -52.64 -38.31 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.505 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.5 t80 -77.48 -58.06 3.48 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.092 -1.413 . . . . 0.0 110.486 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -49.07 -35.85 16.94 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -52.32 58.9 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.204 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' TYR . . . . . 0.884 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.8 m-85 -81.22 -47.38 13.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.768 0.794 . . . . 0.0 110.152 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' ALA . . . . . 0.563 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.98 -20.92 26.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.897 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . . . . . . 0 N--CA 1.45 -0.371 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.327 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.457 -0.085 0 CA-C-O 121.033 0.444 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.9 p -133.91 172.77 12.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.294 0.569 . . . . 0.0 110.798 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.884 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -114.41 -144.74 0.39 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.578 -179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.541 ' H ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -160.65 138.01 9.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.615 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -41.6 44.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.809 0.337 . . . . 0.0 111.045 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' THR . . . . . 0.736 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.86 -45.25 62.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.855 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.41 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.6 mt-10 -57.61 -28.96 64.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.213 0.53 . . . . 0.0 109.952 179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' PHE . . . . . 0.456 ' CE2' ' CB ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -67.43 -33.01 74.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.83 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' LEU . . . . . 0.736 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.0 -59.21 4.41 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.437 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' SER . . . . . 0.593 ' O ' HG22 ' B' ' 41' ' ' THR . 68.9 m -54.2 -48.61 70.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.523 -178.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.516 ' HA ' HG22 ' B' ' 41' ' ' THR . 31.9 t80 -57.88 -27.42 63.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.858 0.361 . . . . 0.0 110.92 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' MET . . . . . 0.89 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -73.76 -58.19 3.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.209 -179.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 1.8 p30 -65.5 -19.32 65.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.051 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.943 HG23 ' HG2' ' B' ' 42' ' ' GLU . 13.3 t -95.98 -31.73 12.93 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' GLU . . . . . 0.943 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -129.25 14.54 6.16 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -177.775 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.776 HD12 ' CE ' ' B' ' 39' ' ' MET . 39.5 mt -161.87 41.47 0.14 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -75.64 -26.26 57.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.799 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.88 -7.6 36.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.036 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -112.28 -13.96 13.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.89 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.2 p . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' VAL . . . . . 0.777 HG12 HD22 ' B' ' 83' ' ' LEU . 32.0 t . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.887 0.375 . . . . 0.0 111.332 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.629 HD12 ' SD ' ' B' ' 59' ' ' MET . 7.0 tp -75.36 -29.5 59.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.657 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -76.05 -28.25 57.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.666 -178.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.23 -45.19 41.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.744 0.307 . . . . 0.0 111.625 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' MET . . . . . 0.884 ' HE3' HD11 ' B' ' 83' ' ' LEU . 0.9 OUTLIER -54.28 -54.42 40.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.169 0.509 . . . . 0.0 112.112 -179.371 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . 0.638 ' H ' ' HG3' ' B' ' 59' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.548 -179.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.42 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.565 0.221 . . . . 0.0 110.786 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.8 OUTLIER -66.46 -146.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 1.3 p30 170.72 -169.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.227 0.536 . . . . 0.0 112.147 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.788 ' CB ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -70.15 -63.93 0.99 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.709 -178.785 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' GLN . . . . . 0.503 HE21 ' CB ' ' B' ' 78' ' ' ASN . 37.6 tp60 -66.35 -34.07 77.15 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.561 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.924 ' O ' HD23 ' B' ' 79' ' ' LEU . 1.9 tt0 -45.06 -47.2 11.85 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.861 0.362 . . . . 0.0 110.095 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.9 t80 -71.01 -46.4 62.27 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.356 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . 0.707 HD13 ' HA3' ' A' ' 81' ' ' GLY . 7.1 mt -56.83 -40.14 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' ASN . . . . . 0.503 ' CB ' HE21 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -39.6 53.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.208 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.924 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -60.21 -58.23 9.39 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.559 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.654 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.2 -46.09 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.655 178.865 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.702 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -54.38 -50.13 57.68 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 178.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' GLY . . . . . 0.406 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.43 37.07 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.433 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.884 HD11 ' HE3' ' B' ' 59' ' ' MET . 11.3 mt -61.59 -43.94 97.92 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.878 0.371 . . . . 0.0 110.003 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.8 ' HB1' ' CZ ' ' A' ' 73' ' ' PHE . . . -55.12 -34.24 63.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.402 0.62 . . . . 0.0 110.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -84.32 -16.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.126 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . 0.509 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.1 13.59 15.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.775 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.5 OUTLIER -157.29 -42.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' HIS . . . . . 0.501 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 20.2 m-70 -75.96 147.78 38.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.96 0.41 . . . . 0.0 111.305 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.37 78.69 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' SER . . . . . 0.473 ' CB ' ' CE2' ' A' ' 73' ' ' PHE . 74.9 m -146.01 -53.57 0.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.534 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' PHE . . . . . 0.711 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -112.99 -44.93 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.702 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' VAL . . . . . 0.487 HG13 ' O ' ' B' ' 85' ' ' VAL . 8.1 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.316 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.569 ' HB2' ' HB2' ' B' ' 45' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.773 0.32 . . . . 0.0 111.183 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' A' ' 3' ' ' PRO . 18.0 mtm180 -158.18 -65.07 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.065 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' A' ' 2' ' ' ARG . 78.4 Cg_endo -76.89 4.45 5.7 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.918 2.412 . . . . 0.0 113.885 -179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.779 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.2 OUTLIER -68.36 137.91 54.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.477 0.656 . . . . 0.0 111.485 -179.161 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.75 -41.31 6.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.211 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.918 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -71.08 -39.41 72.17 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.227 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.779 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.2 mm-40 -51.92 -53.34 42.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.881 0.372 . . . . 0.0 110.422 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -65.94 -26.64 67.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.184 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.552 ' SG ' HD22 ' B' ' 13' ' ' LEU . 0.3 OUTLIER -64.92 -49.86 68.75 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.353 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.051 HG22 HD11 ' A' ' 14' ' ' ILE . 2.8 mp -61.47 -57.16 13.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.744 0.307 . . . . 0.0 111.556 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.907 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -52.89 -27.42 18.55 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.754 -179.286 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.85 -55.44 22.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.702 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.945 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.3 mm? -74.22 -28.61 61.33 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -178.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.051 HD11 HG22 ' A' ' 10' ' ' ILE . 6.3 mt -66.88 -37.06 78.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.336 0.589 . . . . 0.0 111.398 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.39 -32.93 49.06 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.692 -176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.945 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.3 m -52.24 -37.55 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' A' ' 16' ' ' VAL . 3.5 t80 -77.1 -57.95 3.55 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 114.169 -1.378 . . . . 0.0 110.277 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.823 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.3 mm-40 -48.98 -47.21 44.37 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.66 -51.8 20.4 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.69 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.5 m-85 -81.18 -29.76 34.55 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.617 0.722 . . . . 0.0 110.373 178.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.684 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -84.11 12.96 5.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.661 -1.154 . . . . 0.0 112.281 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 139.55 122.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.749 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -96.69 -28.84 14.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.711 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -123.07 29.04 6.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.799 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.17 107.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.439 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.24 -53.3 1.11 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.846 0.355 . . . . 0.0 110.954 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.1 m -154.39 -176.45 5.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.55 HG12 ' O ' ' B' ' 90' ' ' SER . 8.9 m -102.4 22.59 2.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.375 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.684 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.2 p -129.86 -172.17 2.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.759 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.572 HD22 ' N ' ' A' ' 31' ' ' SER . 0.2 OUTLIER -142.71 -121.77 0.09 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.868 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.572 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -172.31 130.96 0.6 Allowed 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 179.801 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.419 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 20.8 mtmt -50.02 -41.39 47.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 111.088 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.704 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -55.97 -28.79 58.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.106 0.479 . . . . 0.0 110.133 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.51 ' CZ ' ' CE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -69.63 -31.98 70.4 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.104 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.704 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.6 mm? -53.12 -59.07 5.01 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.756 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 p -59.58 -41.8 91.05 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.645 -1.162 . . . . 0.0 111.866 -178.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.662 ' HA ' HG22 ' A' ' 41' ' ' THR . 78.8 t80 -57.87 -46.97 84.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.87 0.367 . . . . 0.0 111.339 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.751 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -59.93 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.188 -179.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -73.3 -19.67 60.99 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.95 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.8 t -98.99 -31.07 11.99 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -178.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.95 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.3 mt-10 -132.39 23.82 4.43 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -177.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.912 HD21 HD11 ' B' ' 10' ' ' ILE . 11.8 mt -163.18 52.94 0.17 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.494 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 48' ' ' LYS . . . -75.27 -27.31 59.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.475 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.553 ' HB2' ' HB2' ' B' ' 1' ' ' SER . . . -60.65 -20.03 59.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.564 179.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 36.7 m-85 -97.61 -30.03 13.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.048 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.495 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.3 t -131.41 44.22 2.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.124 -179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.57 108.79 5.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.587 179.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.3 t30 60.47 20.05 9.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.767 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 53.95 35.81 22.84 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -53.09 -28.74 26.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.863 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -133.97 98.71 14.23 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.619 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -83.43 20.33 1.2 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.65 2.233 . . . . 0.0 113.012 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.45 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -113.77 -11.25 13.03 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.86 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.518 HG13 ' HB3' ' A' ' 86' ' ' ALA . 32.7 t -84.54 -63.11 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.844 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.3 -51.54 13.0 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.726 -179.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.844 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.0 t70 -55.28 -38.39 68.53 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.397 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.45 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -75.0 -32.89 61.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.689 0.28 . . . . 0.0 111.685 -179.511 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.968 ' CE ' HD21 ' A' ' 83' ' ' LEU . 8.3 tmm? -73.95 -53.06 10.92 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.825 ' HA ' HD23 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -60.8 -30.4 70.03 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.687 -178.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.471 ' HG3' ' N ' ' A' ' 62' ' ' LYS . 1.0 OUTLIER -78.84 -45.21 21.27 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.471 ' N ' ' HG3' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -80.35 -7.3 59.02 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.825 HD23 ' HA ' ' A' ' 60' ' ' MET . 4.0 pp -57.16 -18.16 14.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.3 t0 55.29 85.99 0.06 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.853 0.359 . . . . 0.0 110.972 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.695 HD21 HD22 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -88.65 118.37 28.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.328 -179.308 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -173.85 33.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.632 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.2 t -111.5 101.68 10.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.725 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 67.41 10.32 7.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.365 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.87 -26.05 10.51 Favored Glycine 0 C--N 1.333 0.402 0 C-N-CA 120.715 -0.755 . . . . 0.0 113.228 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.559 ' O ' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -110.32 -168.47 1.32 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.879 0.339 . . . . 0.0 111.483 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.695 HD22 HD21 ' A' ' 65' ' ' LEU . 0.4 OUTLIER -62.29 -134.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.032 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.42 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 3.0 t0 178.58 -171.15 0.12 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 118.569 0.622 . . . . 0.0 111.623 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.814 ' CD2' HG21 ' B' ' 85' ' ' VAL . 41.3 p90 -83.31 -57.75 3.13 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.27 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.476 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 47.4 tp60 -76.1 -30.71 58.38 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.78 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.763 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -44.7 -42.32 7.51 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.427 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' CZ ' ' A' ' 35' ' ' PHE . 1.7 t80 -70.01 -54.37 13.49 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.936 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.441 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.0 mt -53.58 -33.57 55.29 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.429 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.3 m-20 -74.68 -40.84 61.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.296 178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.883 HD13 ' SD ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -65.05 -57.81 7.7 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.465 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.64 -42.51 48.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.045 179.125 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.86 -50.94 48.23 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.185 -1.007 . . . . 0.0 111.066 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.56 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.37 -41.82 63.51 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 120.365 -0.922 . . . . 0.0 111.843 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.968 HD21 ' CE ' ' A' ' 59' ' ' MET . 3.2 mt -61.21 -42.29 98.35 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.501 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -54.46 -33.19 59.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.428 0.632 . . . . 0.0 110.338 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.55 -17.77 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.466 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.518 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.59 13.68 20.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.19 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 10.9 t -154.58 -43.32 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.781 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -93.87 -164.73 1.21 Allowed 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.705 0.288 . . . . 0.0 110.917 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.421 ' O ' ' CB ' ' A' ' 90' ' ' SER . 8.5 mt-10 -58.34 -163.42 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.908 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.555 ' O ' HG12 ' B' ' 28' ' ' VAL . 0.4 OUTLIER 81.62 -57.45 0.25 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.026 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.13 -45.16 2.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.788 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.482 HG12 ' H ' ' A' ' 93' ' ' LYS . 3.4 t -73.95 166.55 2.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.797 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.482 ' H ' HG12 ' A' ' 92' ' ' VAL . 0.1 OUTLIER 48.51 28.02 1.61 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.285 -179.705 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.8 -37.69 1.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.145 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.752 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -131.76 66.5 78.12 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.075 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.462 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 47.8 Cg_exo -57.37 -46.89 24.8 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.565 2.177 . . . . 0.0 112.326 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 78.7 Cg_endo -87.5 7.99 4.46 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.594 2.196 . . . . 0.0 112.445 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.752 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 2.3 mm-40 -124.67 34.45 5.0 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.059 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -114.9 141.71 47.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.891 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.22 -175.86 4.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.937 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.928 -179.993 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . 0.553 ' HB2' ' HB2' ' A' ' 45' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.757 0.313 . . . . 0.0 111.219 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.469 ' CB ' ' CD ' ' B' ' 3' ' ' PRO . 18.1 mtm180 -158.18 -64.97 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.469 ' CD ' ' CB ' ' B' ' 2' ' ' ARG . 80.2 Cg_endo -77.0 4.44 5.77 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.923 2.416 . . . . 0.0 113.874 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.775 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.2 OUTLIER -68.41 137.88 54.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.434 0.635 . . . . 0.0 111.538 -179.165 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.67 -41.3 6.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.225 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.932 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -71.13 -39.39 72.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.233 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.775 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.95 -53.35 42.28 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.834 0.35 . . . . 0.0 110.369 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 53.1 mtm180 -65.88 -26.65 67.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.176 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.553 ' SG ' HD22 ' A' ' 13' ' ' LEU . 0.3 OUTLIER -64.98 -49.84 68.7 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.316 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.104 HG22 HD11 ' B' ' 14' ' ' ILE . 2.8 mp -61.58 -57.07 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.702 0.287 . . . . 0.0 111.56 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.913 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -52.85 -27.5 18.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.728 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.607 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.81 -55.51 22.47 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.948 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.3 mm? -74.16 -28.63 61.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.104 HD11 HG22 ' B' ' 10' ' ' ILE . 6.3 mt -66.92 -37.0 78.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 O-C-N 121.722 -0.611 . . . . 0.0 111.428 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.37 -32.98 49.21 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.823 -1.081 . . . . 0.0 112.729 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.948 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.0 m -52.13 -37.62 22.64 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.464 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.5 t80 -77.03 -58.02 3.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.137 -1.392 . . . . 0.0 110.252 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.811 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.4 mm-40 -49.03 -47.2 44.81 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -47.58 -51.9 19.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.668 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.49 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.5 m-85 -81.1 -29.83 34.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.58 0.705 . . . . 0.0 110.45 178.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -84.03 12.97 5.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.628 -1.169 . . . . 0.0 112.346 -178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 139.55 122.27 1.95 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.734 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mttt -96.65 -28.9 14.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.803 0.335 . . . . 0.0 110.727 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -123.02 28.9 6.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.817 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.34 107.18 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.486 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.14 -53.38 1.12 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.855 0.36 . . . . 0.0 110.936 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 22.0 m -154.37 -176.42 5.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.859 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 90' ' ' SER . 8.4 m -102.48 22.63 2.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.27 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.2 p -129.84 -172.07 2.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.753 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.58 HD22 ' N ' ' B' ' 31' ' ' SER . 0.2 OUTLIER -142.83 -121.7 0.09 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.865 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.58 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -172.38 130.96 0.59 Allowed 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.771 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.422 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 20.8 mtmt -49.96 -41.41 46.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.124 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.706 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.15 -41.95 60.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.982 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.532 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -55.98 -28.75 58.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.071 0.462 . . . . 0.0 110.121 179.678 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.513 ' CZ ' ' CE1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -69.66 -32.06 70.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.055 178.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.706 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.6 mm? -53.08 -59.03 5.06 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.803 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.547 ' O ' HG22 ' B' ' 41' ' ' THR . 3.1 p -59.63 -41.74 91.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.919 -178.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.646 ' HA ' HG22 ' B' ' 41' ' ' THR . 78.8 t80 -57.88 -46.98 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 111.311 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.75 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -59.91 -49.93 75.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.219 -179.534 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 -73.33 -19.7 60.96 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.448 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.99 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.9 t -98.98 -31.08 11.99 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.99 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.3 mt-10 -132.32 23.84 4.46 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.917 HD21 HD11 ' A' ' 10' ' ' ILE . 11.8 mt -163.18 52.93 0.17 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.002 0.429 . . . . 0.0 110.399 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' B' ' 48' ' ' LYS . . . -75.21 -27.33 59.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.485 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . 0.569 ' HB2' ' HB2' ' A' ' 1' ' ' SER . . . -60.62 -19.92 59.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.598 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 37.0 m-85 -97.74 -30.11 12.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.052 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.489 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.3 t -131.35 44.43 2.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.088 -179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -71.72 108.81 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 4.3 t30 60.56 19.9 9.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.752 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 54.01 35.93 23.27 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -53.16 -28.74 27.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -133.93 98.71 14.29 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.653 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -83.38 20.29 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.681 2.254 . . . . 0.0 112.976 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -113.79 -11.18 13.1 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.625 -0.797 . . . . 0.0 112.889 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.519 HG13 ' HB3' ' B' ' 86' ' ' ALA . 32.7 t -84.53 -63.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.033 0.444 . . . . 0.0 111.47 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.847 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.32 -51.5 13.06 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.727 -179.259 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.847 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.0 t70 -55.36 -38.47 68.85 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.32 -178.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -74.92 -32.89 61.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.731 0.3 . . . . 0.0 111.666 -179.456 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.967 ' CE ' HD21 ' B' ' 83' ' ' LEU . 8.3 tmm? -74.05 -52.95 11.09 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.826 ' HA ' HD23 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -60.81 -30.35 70.02 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.739 -178.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' B' ' 62' ' ' LYS . 1.0 OUTLIER -78.9 -45.24 21.01 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.476 ' N ' ' HG3' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -80.23 -7.39 58.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.843 HD22 HD11 ' B' ' 79' ' ' LEU . 4.0 pp -57.15 -18.22 14.26 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 12.2 t0 55.38 85.94 0.06 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.826 0.346 . . . . 0.0 110.97 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.707 HD21 HD22 ' B' ' 71' ' ' LEU . 0.2 OUTLIER -88.68 118.31 28.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.076 0.465 . . . . 0.0 111.39 -179.334 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 11.9 m-20 -173.75 33.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.634 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 7.2 t -111.52 101.73 10.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.687 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 67.35 10.28 7.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.39 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.9 -26.0 10.64 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.186 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.554 ' O ' HD11 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -110.37 -168.44 1.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.909 0.355 . . . . 0.0 111.464 -179.439 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.707 HD22 HD21 ' B' ' 65' ' ' LEU . 0.4 OUTLIER -62.36 -134.97 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.95 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 3.1 t0 178.64 -171.12 0.12 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.494 0.588 . . . . 0.0 111.532 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 41.6 p90 -83.2 -57.8 3.12 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.274 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.479 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 47.4 tp60 -76.1 -30.68 58.35 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.761 -179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.758 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -44.75 -42.34 7.63 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.513 ' CE1' ' CZ ' ' B' ' 35' ' ' PHE . 1.7 t80 -70.0 -54.28 13.9 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.381 -0.528 . . . . 0.0 109.983 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.0 mt -53.58 -33.6 55.39 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 178.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.479 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.3 m-20 -74.76 -40.7 61.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.312 178.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.882 HD13 ' SD ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -65.06 -57.84 7.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.434 -179.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.73 -42.39 47.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.082 179.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.43 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.98 -50.89 49.18 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.146 -1.026 . . . . 0.0 111.06 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.34 -41.86 63.27 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.787 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.967 HD21 ' CE ' ' B' ' 59' ' ' MET . 3.2 mt -61.2 -42.23 98.23 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.921 0.391 . . . . 0.0 110.135 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.518 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -54.57 -33.13 59.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.414 0.626 . . . . 0.0 110.327 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.814 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.373 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.519 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -112.71 13.78 19.9 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.112 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.426 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 10.9 t -154.65 -43.13 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.841 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -94.09 -164.78 1.21 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.784 0.326 . . . . 0.0 110.822 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' B' ' 90' ' ' SER . 8.7 mt-10 -58.34 -163.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.887 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.55 ' O ' HG12 ' A' ' 28' ' ' VAL . 0.4 OUTLIER 81.61 -57.42 0.25 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.012 -179.799 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.11 -45.19 2.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.888 0.375 . . . . 0.0 110.829 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.498 HG12 ' H ' ' B' ' 93' ' ' LYS . 3.4 t -73.87 166.56 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.498 ' H ' HG12 ' B' ' 92' ' ' VAL . 0.1 OUTLIER 48.53 27.94 1.59 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.291 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.78 -37.65 1.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.205 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.769 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -131.76 66.47 78.05 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.064 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.469 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 47.9 Cg_exo -57.35 -46.96 24.41 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.579 2.186 . . . . 0.0 112.369 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 75.8 Cg_endo -87.38 8.02 4.48 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.635 2.224 . . . . 0.0 112.562 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.769 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 2.3 mm-40 -124.71 34.29 5.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.087 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -114.78 141.81 47.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.882 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.27 -175.87 4.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.894 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.205 -0.903 . . . . 0.0 110.924 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.444 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -95.72 -53.05 0.23 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.124 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.444 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 31.4 Cg_exo -63.53 -127.29 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.895 2.397 . . . . 0.0 111.842 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -144.48 145.23 31.76 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.307 0.575 . . . . 0.0 111.076 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.87 -44.58 9.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.322 -0.853 . . . . 0.0 111.056 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.981 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.2 -40.45 94.2 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.914 178.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -50.98 -36.05 37.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.575 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.73 -26.89 40.66 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.582 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.626 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.7 p -68.07 -41.95 81.15 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.639 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 3.4 mp -72.09 -54.51 16.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 120.707 0.289 . . . . 0.0 111.53 -179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.956 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.66 -27.35 11.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -178.478 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.649 ' O ' HG13 ' A' ' 16' ' ' VAL . 52.2 m -77.59 -56.03 4.87 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.771 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.733 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -57.95 -27.85 63.78 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.968 0.413 . . . . 0.0 111.778 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 13.4 mt -71.81 -39.57 68.2 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-O 121.573 0.701 . . . . 0.0 110.512 178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.612 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -77.47 -38.26 49.62 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.935 -1.484 . . . . 0.0 112.084 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.733 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.6 m -52.6 -33.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.47 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 1.6 t80 -80.51 -58.48 3.1 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.413 -1.267 . . . . 0.0 112.943 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.931 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.47 -27.53 64.3 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.899 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -50.28 72.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.202 0.525 . . . . 0.0 109.685 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.529 ' CD1' ' CG ' ' A' ' 38' ' ' PHE . 3.1 m-85 -79.44 -28.47 41.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.479 178.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.931 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -80.36 2.19 25.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.016 -179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.08 141.85 11.11 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.633 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.57 -32.13 6.78 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 110.835 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.84 124.89 45.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.1 -30.17 10.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.525 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.5 m80 61.36 112.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.783 0.325 . . . . 0.0 110.877 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.508 ' C ' HG23 ' A' ' 28' ' ' VAL . 8.5 m -109.72 -28.46 8.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.078 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.508 HG23 ' C ' ' A' ' 27' ' ' SER . 4.8 t 81.64 -6.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.824 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.711 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p -139.29 -179.8 6.08 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.883 0.373 . . . . 0.0 110.813 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.3 0.19 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.435 -179.698 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.53 ' HB3' ' HB2' ' A' ' 34' ' ' GLU . 28.8 t -173.63 126.71 0.4 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 120.807 0.337 . . . . 0.0 110.121 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.4 OUTLIER -49.82 -36.34 26.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.422 -179.126 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.09 -43.08 58.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.072 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.24 59.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.069 0.462 . . . . 0.0 110.154 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.935 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -72.92 -29.45 63.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.908 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.641 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -59.13 -59.24 5.78 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.545 0.688 . . . . 0.0 111.507 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.425 ' O ' HG22 ' A' ' 41' ' ' THR . 33.7 t -68.03 -50.41 55.53 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.464 -178.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.529 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.8 m-85 -57.93 -25.89 61.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.228 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.607 ' HE2' HD13 ' A' ' 43' ' ' LEU . 1.5 ttm -78.17 -53.66 7.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.056 0.455 . . . . 0.0 110.531 179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.69 30.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.095 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.937 HG23 ' HG2' ' A' ' 42' ' ' GLU . 9.2 t -96.87 -30.28 13.23 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.937 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -125.94 -42.18 1.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.664 HD21 HD11 ' B' ' 10' ' ' ILE . 7.4 mt -101.88 34.94 2.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.315 0.579 . . . . 0.0 110.162 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.479 ' HB1' ' HB3' ' A' ' 48' ' ' LYS . . . -81.16 -28.84 34.86 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.924 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.55 -25.54 17.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.427 ' CZ ' ' CE1' ' A' ' 88' ' ' HIS . 4.5 m-85 -102.32 17.05 24.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.088 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t -178.45 45.67 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.901 0.382 . . . . 0.0 110.992 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HB3' ' HB1' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -120.04 -37.52 3.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.79 28.8 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.824 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -78.92 -22.34 45.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 tttm 65.3 30.95 10.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.708 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -131.85 83.18 57.93 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.931 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -61.55 -16.31 47.09 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.633 2.222 . . . . 0.0 112.348 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -71.94 -14.27 75.9 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.793 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' A' ' 86' ' ' ALA . 61.7 t -84.2 -59.48 2.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.56 -50.94 63.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.663 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -57.01 -26.69 60.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.064 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.53 -50.05 75.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.827 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE2' HD21 ' A' ' 83' ' ' LEU . 1.3 ptp -56.36 -53.5 56.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.062 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.934 ' O ' HD22 ' A' ' 63' ' ' LEU . 3.6 mmt -64.33 -22.75 67.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.891 -179.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.5 mmmt -78.46 -61.66 1.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.919 0.39 . . . . 0.0 110.685 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.24 6.09 15.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.068 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.934 HD22 ' O ' ' A' ' 60' ' ' MET . 1.3 pt? -50.41 -24.76 3.27 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.523 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.8 OUTLIER 69.15 64.18 0.29 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.973 0.416 . . . . 0.0 110.735 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.703 HD23 ' HG ' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -121.85 156.54 33.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.708 -179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -156.23 -74.26 0.1 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.889 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 7.7 p -167.04 130.74 1.87 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.871 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 99.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.805 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' O ' HG21 ' A' ' 29' ' ' THR . . . 159.94 -29.45 0.37 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.471 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.419 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER 60.16 -167.78 0.17 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.626 0.25 . . . . 0.0 110.846 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -63.27 -135.41 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.48 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER 172.79 -168.7 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 118.761 0.71 . . . . 0.0 111.753 179.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.7 ' CG ' HG11 ' B' ' 85' ' ' VAL . 31.8 p90 -76.21 -60.71 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.612 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.496 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.32 -25.61 39.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.438 179.402 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.7 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.4 OUTLIER -46.4 -31.77 2.84 Favored 'General case' 0 CA--C 1.522 -0.124 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 178.683 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.644 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.5 t80 -80.33 -54.35 5.8 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.856 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' B' ' 77' ' ' LEU . 7.3 mt -55.95 -33.52 64.81 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.726 179.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.456 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.2 OUTLIER -75.85 -37.46 58.95 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.935 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.1 mp -66.08 -58.19 6.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.023 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.872 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.08 -44.77 49.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.562 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.474 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.82 -49.31 54.79 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 110.208 -1.157 . . . . 0.0 110.208 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.58 -43.59 53.2 Favored Glycine 0 C--N 1.332 0.316 0 C-N-CA 120.33 -0.938 . . . . 0.0 111.363 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.4 mt -56.85 -44.84 82.53 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.891 0.377 . . . . 0.0 110.018 178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.484 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.47 -41.62 73.21 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.186 0.517 . . . . 0.0 110.913 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.695 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -73.74 -17.11 17.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.285 -179.513 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -109.11 16.37 22.58 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.565 -179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 44.8 t -158.38 -35.88 0.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -118.35 -67.87 0.96 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.693 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 2.1 mm-40 -36.55 156.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.128 0.49 . . . . 0.0 112.234 -178.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.19 66.18 0.11 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.146 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.41 -48.96 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.718 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.2 p -68.87 -24.99 29.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.135 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -78.64 -20.9 49.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.108 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.56 27.98 3.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.821 0.343 . . . . 0.0 111.333 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.717 ' HB3' ' HD3' ' A' ' 96' ' ' PRO . . . -88.02 -51.48 0.4 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.126 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.717 ' HD3' ' HB3' ' A' ' 95' ' ' ALA . 54.4 Cg_exo -54.14 -46.81 30.76 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.718 2.279 . . . . 0.0 112.824 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.531 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 62.6 Cg_endo -73.6 -33.97 6.13 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.091 1.86 . . . . 0.0 112.377 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.14 135.91 38.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.823 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -113.42 125.54 54.36 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.952 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.6 -45.02 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.915 179.96 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.735 0.303 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.438 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 0.0 OUTLIER -95.78 -52.99 0.23 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.098 -179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 31.5 Cg_exo -63.5 -127.25 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.498 0 C-N-CA 122.926 2.417 . . . . 0.0 111.873 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.66 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -144.55 145.29 31.75 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.363 0.601 . . . . 0.0 110.966 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -44.83 -44.66 9.67 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.998 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.21 -40.43 94.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.824 178.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.66 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.05 -36.14 38.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.47 -179.826 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.9 ttm-85 -79.71 -26.82 40.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.636 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.631 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -67.93 -42.15 81.48 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.017 HG22 HD11 ' B' ' 14' ' ' ILE . 3.4 mp -71.93 -54.52 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.629 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.76 -27.23 11.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 52.2 m -77.69 -56.0 4.88 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.819 -0.352 . . . . 0.0 111.755 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.73 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.7 mm? -57.9 -27.8 63.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 120.991 0.424 . . . . 0.0 111.796 -179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.017 HD11 HG22 ' B' ' 10' ' ' ILE . 13.7 mt -71.96 -39.58 66.88 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 CA-C-O 121.481 0.658 . . . . 0.0 110.417 178.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . 0.615 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -77.42 -38.31 49.91 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 113.967 -1.47 . . . . 0.0 112.105 -176.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.73 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.3 m -52.56 -33.61 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.472 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 1.6 t80 -80.4 -58.66 3.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.436 -1.256 . . . . 0.0 112.897 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.926 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.38 -27.54 64.4 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.47 -50.3 72.12 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.522 ' CD1' ' CG ' ' B' ' 38' ' ' PHE . 3.1 m-85 -79.35 -28.55 42.01 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.515 178.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.926 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -80.4 2.41 25.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.695 -1.139 . . . . 0.0 112.103 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 92.91 141.89 11.06 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.71 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -111.51 -32.19 6.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.811 0.338 . . . . 0.0 110.895 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.82 125.02 45.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 103.09 -30.2 10.88 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.508 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 6.5 m80 61.27 112.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.859 0.361 . . . . 0.0 110.937 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . 0.513 ' C ' HG23 ' B' ' 28' ' ' VAL . 8.3 m -109.65 -28.5 8.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.051 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.513 HG23 ' C ' ' B' ' 27' ' ' SER . 4.8 t 81.58 -6.84 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.802 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.706 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p -139.33 -179.91 6.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.967 0.413 . . . . 0.0 110.773 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.685 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -132.01 -124.21 0.19 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.504 ' HB3' ' HB2' ' B' ' 34' ' ' GLU . 28.7 t -173.7 126.56 0.39 Allowed 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 120.812 0.339 . . . . 0.0 110.092 179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.435 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.4 OUTLIER -49.68 -36.43 25.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.459 -179.174 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.652 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.07 -43.06 59.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.061 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.504 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 0.1 OUTLIER -55.95 -29.25 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.98 0.419 . . . . 0.0 110.094 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.946 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -72.91 -29.43 63.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.941 179.073 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.652 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -59.19 -59.16 5.91 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.562 0.696 . . . . 0.0 111.565 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.429 ' O ' HG22 ' B' ' 41' ' ' THR . 33.6 t -67.95 -50.42 55.98 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.528 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.522 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.9 m-85 -57.99 -25.96 61.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.129 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.594 ' HE1' HD13 ' B' ' 43' ' ' LEU . 1.5 ttm -78.16 -53.61 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.047 0.451 . . . . 0.0 110.541 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 60.6 m-80 -57.84 -19.65 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.149 -179.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.958 HG23 ' HG2' ' B' ' 42' ' ' GLU . 9.2 t -96.83 -30.32 13.23 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.958 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.4 OUTLIER -125.9 -42.15 1.92 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.572 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.678 HD21 HD11 ' A' ' 10' ' ' ILE . 7.4 mt -101.89 34.99 2.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.291 0.567 . . . . 0.0 110.053 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.485 ' HB1' ' HB3' ' B' ' 48' ' ' LYS . . . -81.27 -28.77 34.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.903 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.62 -25.51 17.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.801 179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.421 ' CZ ' ' CE1' ' B' ' 88' ' ' HIS . 4.5 m-85 -102.29 16.96 24.65 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.08 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.9 t -178.3 45.62 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.864 0.364 . . . . 0.0 111.003 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.485 ' HB3' ' HB1' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -120.03 -37.56 3.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.028 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -153.71 28.71 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.833 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -78.88 -22.42 45.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.2 tttm 65.33 30.9 10.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.783 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -131.8 83.15 58.21 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.879 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.32 -16.51 47.35 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.742 2.295 . . . . 0.0 112.379 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -71.91 -14.22 75.82 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.845 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.664 HG13 ' HB3' ' B' ' 86' ' ' ALA . 62.0 t -84.21 -59.49 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 111.215 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 7.9 tp -65.51 -51.06 62.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.602 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -56.93 -26.76 60.03 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.063 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -58.52 -50.0 75.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.818 -179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 1.3 ptp -56.34 -53.53 56.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.086 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.937 ' O ' HD22 ' B' ' 63' ' ' LEU . 3.6 mmt -64.22 -22.86 67.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.879 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 7.5 mmmt -78.44 -61.77 1.9 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.14 6.01 15.09 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.092 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.937 HD22 ' O ' ' B' ' 60' ' ' MET . 1.3 pt? -50.32 -24.77 3.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.519 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.8 OUTLIER 69.12 64.21 0.29 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.693 HD23 ' HG ' ' B' ' 63' ' ' LEU . 0.5 OUTLIER -121.84 156.61 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.719 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -156.27 -74.26 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.932 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 7.5 p -167.02 130.72 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.833 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 99.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.453 ' O ' HG21 ' B' ' 29' ' ' THR . . . 159.89 -29.42 0.37 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.458 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.428 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.0 OUTLIER 60.25 -167.71 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.517 0.199 . . . . 0.0 110.864 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -63.39 -135.42 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.484 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 0.8 OUTLIER 172.91 -168.62 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 118.819 0.736 . . . . 0.0 111.756 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.695 ' CG ' HG11 ' A' ' 85' ' ' VAL . 31.8 p90 -76.31 -60.62 2.26 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.568 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.507 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.38 -25.53 39.08 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.441 179.466 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.711 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.4 OUTLIER -46.46 -31.75 2.88 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 178.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.659 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.5 t80 -80.29 -54.45 5.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.805 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.85 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -55.93 -33.54 64.8 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.68 179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.46 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.2 OUTLIER -75.82 -37.43 59.09 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 177.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.946 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.1 mp -66.06 -58.2 6.01 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.111 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.86 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.1 -44.77 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.179 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.54 179.047 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.481 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.8 -49.3 54.7 Favored Glycine 0 C--N 1.333 0.383 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 178.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.479 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.44 -43.62 52.34 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.44 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.4 mt -56.86 -44.85 82.58 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.88 0.371 . . . . 0.0 110.025 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' GLU . . . -55.45 -41.66 73.18 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 121.205 0.526 . . . . 0.0 110.897 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.7 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -73.69 -17.27 17.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.209 -179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.664 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -108.95 16.37 22.7 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.54 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 44.6 t -158.38 -35.98 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.524 ' HB3' HD13 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -118.29 -67.79 0.96 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -178.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.696 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 2.1 mm-40 -36.52 156.47 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.14 66.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.159 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -142.49 -49.01 0.35 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.723 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.3 p -68.81 -25.0 29.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -78.69 -20.83 49.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.171 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -95.57 27.92 3.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.795 0.331 . . . . 0.0 111.319 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.709 ' HB3' ' HD3' ' B' ' 96' ' ' PRO . . . -88.05 -51.32 0.4 Allowed Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.709 ' HD3' ' HB3' ' B' ' 95' ' ' ALA . 55.3 Cg_exo -54.27 -46.7 31.57 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.736 2.29 . . . . 0.0 112.852 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 62.4 Cg_endo -73.65 -34.09 5.93 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.167 1.911 . . . . 0.0 112.367 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.12 135.83 38.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.793 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 46.8 mttt -113.31 125.55 54.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.61 -45.0 1.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.917 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 4.5 t80 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.889 179.947 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.863 0.363 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 61.1 103.79 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.831 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -61.14 -124.68 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.909 2.406 . . . . 0.0 111.869 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.687 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -170.96 144.05 2.1 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.34 0.59 . . . . 0.0 111.254 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.91 -41.78 7.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.97 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.924 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -67.94 -38.75 83.24 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.048 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.687 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.4 -33.46 30.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.437 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.62 -27.11 41.02 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.562 178.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.572 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.4 p -69.07 -45.16 71.03 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.252 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.087 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -65.98 -56.37 15.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.49 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.95 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.17 -27.27 13.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.674 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.542 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.3 OUTLIER -69.84 -55.52 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.923 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -68.58 -27.28 65.92 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -178.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.087 HD11 HG22 ' A' ' 10' ' ' ILE . 8.3 mt -69.47 -35.45 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-O 121.216 0.531 . . . . 0.0 110.778 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.37 51.21 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.435 -1.257 . . . . 0.0 112.538 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.923 HG22 ' O ' ' A' ' 13' ' ' LEU . 29.6 m -63.53 -37.11 78.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.167 0.508 . . . . 0.0 109.943 178.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.458 ' CE1' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.53 -60.1 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.847 -178.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.967 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -58.18 -26.66 63.04 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.36 -52.16 48.12 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.306 -0.557 . . . . 0.0 109.708 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.646 ' HB3' HD11 ' A' ' 30' ' ' LEU . 2.9 m-85 -80.53 -29.77 37.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.62 0.724 . . . . 0.0 109.235 176.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.967 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -83.3 20.08 1.38 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.523 -1.217 . . . . 0.0 112.218 -179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.18 124.4 2.14 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.501 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -114.93 30.55 7.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.779 0.323 . . . . 0.0 110.819 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -136.21 -50.42 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.954 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.66 71.47 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.526 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -148.59 97.26 2.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.83 0.347 . . . . 0.0 110.826 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.5 m 62.24 147.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.945 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m -104.27 37.62 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 5.9 p -146.11 158.76 43.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.09 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.769 HD12 ' CD2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -117.39 -156.16 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.893 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.512 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -137.88 136.45 37.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 179.085 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.503 ' O ' HD23 ' A' ' 36' ' ' LEU . 21.5 mtmt -49.86 -39.78 40.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.688 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.31 -44.58 51.98 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.28 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.436 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 1.3 tt0 -59.81 -29.14 68.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.286 0.565 . . . . 0.0 109.941 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.769 ' CD2' HD12 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -75.59 -26.61 58.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.552 179.506 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.649 ' HB2' ' O ' ' A' ' 33' ' ' THR . 2.4 mm? -51.35 -59.26 4.42 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.686 0.755 . . . . 0.0 110.647 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.15 69.42 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.477 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 12.5 t80 -57.84 -28.98 64.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.402 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.459 ' CE ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -78.0 -35.94 49.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.055 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.769 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 59.7 m-80 -73.21 -19.78 61.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.212 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.78 -78.57 0.59 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.139 0.495 . . . . 0.0 111.606 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 1.9 mm-40 -51.36 -28.41 12.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.032 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.706 HD21 HD11 ' B' ' 10' ' ' ILE . 39.3 mt -134.57 51.48 2.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.056 0.455 . . . . 0.0 110.478 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.769 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.75 -25.39 53.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.946 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.86 -14.52 63.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.134 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.42 -21.54 15.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.26 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -108.0 -21.14 12.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.377 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.68 ' HE2' ' HB1' ' A' ' 44' ' ' ALA . 18.1 mttm -55.13 135.4 49.32 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.131 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.405 ' CB ' ' O ' ' A' ' 48' ' ' LYS . 0.7 OUTLIER 80.41 -43.14 0.23 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.52 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 69.8 30.71 3.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.882 0.373 . . . . 0.0 110.78 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -27.58 63.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.771 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.37 75.4 0.37 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.802 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.5 87.99 0.41 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.556 2.171 . . . . 0.0 112.234 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.55 -39.14 0.16 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.41 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 86' ' ' ALA . 22.9 t -51.78 -63.03 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.898 0.38 . . . . 0.0 111.386 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -51.1 70.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.756 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.82 -30.89 62.14 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.372 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -42.75 92.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.008 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.855 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.4 OUTLIER -63.43 -53.54 50.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.339 -179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.91 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -60.56 -29.75 69.36 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.298 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -59.55 2.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.893 0.378 . . . . 0.0 110.792 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.37 6.13 13.01 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.875 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.91 HD22 ' O ' ' A' ' 60' ' ' MET . 1.8 pt? -44.85 -33.26 1.87 Allowed 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.985 0.422 . . . . 0.0 111.516 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.588 ' H ' HD23 ' A' ' 63' ' ' LEU . 36.5 t70 43.91 82.7 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.9 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.744 HD21 HD12 ' A' ' 63' ' ' LEU . 38.2 mt -88.48 107.24 18.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.89 0.376 . . . . 0.0 110.663 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -94.59 -33.96 12.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.015 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.01 -175.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.855 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.36 -23.93 26.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.092 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 155.83 -24.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 -69.73 173.33 6.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.695 0.283 . . . . 0.0 111.062 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.606 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -65.9 -136.89 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 179.428 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.501 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.03 -164.9 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.602 0.637 . . . . 0.0 111.603 179.557 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.916 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.3 p90 -81.71 -57.2 3.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.357 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.492 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 44.6 tp60 -80.35 -27.91 38.2 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.325 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.809 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -44.78 -36.59 3.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.649 ' CD2' HG23 ' A' ' 16' ' ' VAL . 2.0 t80 -80.38 -54.24 5.89 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.036 178.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.635 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.5 mt -50.12 -34.55 22.51 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.492 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.84 -38.46 53.75 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 75' ' ' GLU . 1.8 mp -63.82 -58.15 7.7 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.798 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.893 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.6 -42.37 63.06 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.174 178.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.75 -49.92 51.81 Favored Glycine 0 CA--C 1.507 -0.446 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.598 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.54 -40.26 46.91 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.426 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.855 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.3 mt -60.26 -45.53 92.95 Favored 'General case' 0 C--O 1.23 0.056 0 O-C-N 122.571 -0.37 . . . . 0.0 110.327 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.581 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.44 -30.76 61.11 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.175 0.512 . . . . 0.0 110.843 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.91 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.99 -17.48 9.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.168 -179.657 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.718 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.31 12.83 17.7 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.199 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.14 -37.22 0.12 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.506 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.1 OUTLIER -89.37 -171.08 3.09 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.913 0.387 . . . . 0.0 111.3 -179.686 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.61 55.18 3.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.4 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.798 ' OG ' HG23 ' B' ' 14' ' ' ILE . 0.6 OUTLIER -117.57 -47.68 2.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.953 0.406 . . . . 0.0 110.412 179.377 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.755 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -135.37 -81.55 0.42 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.423 179.289 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.582 HG22 ' O ' ' A' ' 91' ' ' PHE . 7.2 m 45.15 18.62 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 179.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 92' ' ' VAL . 0.0 OUTLIER 61.57 23.03 13.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.998 0.428 . . . . 0.0 110.942 -179.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . 52.94 68.44 0.84 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.012 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.639 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -139.03 57.03 10.01 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.545 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.511 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 32.2 Cg_exo -59.84 -48.16 13.49 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.44 2.094 . . . . 0.0 112.638 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.466 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 62.8 Cg_endo -90.52 29.46 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.77 2.313 . . . . 0.0 112.769 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.639 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.2 OUTLIER -96.33 -26.98 15.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.196 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -58.52 -51.79 68.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.012 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.23 29.79 0.89 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.869 0.366 . . . . 0.0 111.413 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.872 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 5.2 t . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.824 0.345 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 61.11 103.67 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -60.99 -124.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.909 2.406 . . . . 0.0 111.893 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.672 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -170.97 144.1 2.1 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.342 0.592 . . . . 0.0 111.25 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -41.76 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.953 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.903 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -68.0 -38.71 82.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.029 179.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.672 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.31 -33.56 29.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.469 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -79.59 -27.17 41.12 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.519 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.4 p -69.08 -45.1 71.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.211 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -66.09 -56.31 15.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.404 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.953 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.24 -27.21 13.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.679 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.3 OUTLIER -69.9 -55.56 9.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.32 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.907 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -68.51 -27.25 65.95 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.3 mt -69.42 -35.47 67.16 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.817 0 CA-C-O 121.217 0.532 . . . . 0.0 110.832 179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -77.66 -28.38 51.21 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.408 -1.269 . . . . 0.0 112.613 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.907 HG22 ' O ' ' B' ' 13' ' ' LEU . 29.3 m -63.46 -37.2 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 121.231 0.538 . . . . 0.0 109.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.455 ' CE1' ' CB ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -80.48 -60.02 2.48 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.881 -178.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.915 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.1 OUTLIER -58.19 -26.75 63.15 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -178.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -51.28 -52.08 48.29 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.737 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.641 ' HB3' HD11 ' B' ' 30' ' ' LEU . 2.8 m-85 -80.64 -29.8 36.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.656 0.741 . . . . 0.0 109.215 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.915 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -83.3 20.13 1.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.172 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.14 124.32 2.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.533 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 tptt -114.83 30.49 7.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.721 0.296 . . . . 0.0 110.81 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -136.24 -50.41 0.69 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.926 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 153.72 71.51 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.591 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -148.6 97.17 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.734 0.302 . . . . 0.0 110.885 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m 62.39 147.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.909 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 m -104.2 37.62 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.969 0.414 . . . . 0.0 111.138 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 5.8 p -146.19 158.75 43.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.034 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.762 HD12 ' CD2' ' B' ' 35' ' ' PHE . 0.0 OUTLIER -117.43 -156.14 0.62 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.88 179.598 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.511 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -137.89 136.41 37.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.947 0.403 . . . . 0.0 110.545 179.069 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.501 ' O ' HD23 ' B' ' 36' ' ' LEU . 21.5 mtmt -49.87 -39.75 40.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.673 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.646 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.29 -44.67 51.75 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.27 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.441 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 1.3 tt0 -59.88 -28.98 68.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.223 0.535 . . . . 0.0 109.987 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.762 ' CD2' HD12 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -75.6 -26.61 57.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.58 179.415 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' B' ' 33' ' ' THR . 2.4 mm? -51.49 -59.21 4.51 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.709 0.766 . . . . 0.0 110.571 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 p -53.35 -46.17 69.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.422 -1.263 . . . . 0.0 110.407 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.466 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 12.6 t80 -57.92 -28.86 64.65 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.389 179.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.464 ' CE ' HD12 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -78.14 -35.84 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.942 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.768 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 59.8 m-80 -73.26 -19.79 60.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.178 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.9 p -107.81 -78.65 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 111.602 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.466 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 1.9 mm-40 -51.34 -28.39 12.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.082 -179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' A' ' 10' ' ' ILE . 38.7 mt -134.64 51.56 2.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.033 0.444 . . . . 0.0 110.482 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.768 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.83 -25.35 53.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.932 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.78 -14.52 63.02 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.174 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -99.45 -21.5 15.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.2 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 7.5 p -108.03 -21.18 12.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.412 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.695 ' HE2' ' HB1' ' B' ' 44' ' ' ALA . 18.0 mttm -55.09 135.4 49.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.174 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.402 ' CB ' ' O ' ' B' ' 48' ' ' LYS . 0.7 OUTLIER 80.45 -43.28 0.23 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.465 179.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 69.91 30.68 3.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.844 0.354 . . . . 0.0 110.758 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -27.66 64.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.866 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.33 75.3 0.36 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.779 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -68.47 87.96 0.41 Allowed 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.524 2.149 . . . . 0.0 112.324 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 172.55 -39.16 0.16 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.418 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.717 HG22 ' O ' ' B' ' 86' ' ' ALA . 22.6 t -51.77 -63.08 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.893 0.377 . . . . 0.0 111.391 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 6.5 tp -61.37 -50.97 70.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -55.85 -30.91 62.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.347 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -42.79 92.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 111.043 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.866 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.4 OUTLIER -63.48 -53.51 51.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.32 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.897 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -60.59 -29.73 69.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.299 -179.439 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.23 -59.52 2.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.902 0.382 . . . . 0.0 110.83 179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.46 6.17 13.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.832 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.897 HD22 ' O ' ' B' ' 60' ' ' MET . 1.8 pt? -44.83 -33.24 1.85 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 111.574 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.572 ' H ' HD23 ' B' ' 63' ' ' LEU . 36.5 t70 43.87 82.67 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.913 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.733 HD21 HD12 ' B' ' 63' ' ' LEU . 38.3 mt -88.44 107.27 18.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.926 0.393 . . . . 0.0 110.706 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -94.59 -33.99 12.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.02 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.94 -175.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.871 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.51 -23.93 28.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.09 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 155.92 -24.56 0.55 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.565 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.509 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 -69.66 173.3 6.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 111.027 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.609 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.4 OUTLIER -65.83 -136.86 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 172.01 -164.89 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 118.574 0.625 . . . . 0.0 111.613 179.512 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.91 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.4 p90 -81.73 -57.16 3.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.384 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.488 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 44.7 tp60 -80.38 -27.8 38.08 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.348 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.811 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -44.94 -36.52 3.41 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.642 ' CD2' HG23 ' B' ' 16' ' ' VAL . 2.0 t80 -80.35 -54.19 5.94 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.077 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.624 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.5 mt -50.17 -34.53 22.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.488 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.86 -38.58 53.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.811 HD13 ' O ' ' B' ' 75' ' ' GLU . 1.8 mp -63.77 -58.24 7.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.713 178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.905 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.66 -42.33 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.15 178.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.434 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.68 -50.04 50.83 Favored Glycine 0 CA--C 1.507 -0.461 0 N-CA-C 109.989 -1.245 . . . . 0.0 109.989 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.594 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.38 -40.39 45.95 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.403 -0.903 . . . . 0.0 111.446 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.866 HD21 ' CE ' ' B' ' 59' ' ' MET . 6.1 mt -60.17 -45.63 92.45 Favored 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.332 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.585 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.36 -30.8 61.01 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.281 0.562 . . . . 0.0 110.891 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.916 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.04 -17.34 9.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.227 -179.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.717 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.35 12.79 17.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.194 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.16 -37.24 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.459 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.1 OUTLIER -89.3 -171.07 3.1 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.838 0.351 . . . . 0.0 111.356 -179.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -86.57 55.16 3.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.447 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.805 ' OG ' HG23 ' A' ' 14' ' ' ILE . 0.6 OUTLIER -117.6 -47.59 2.62 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.406 179.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -135.43 -81.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.412 179.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.571 HG22 ' O ' ' B' ' 91' ' ' PHE . 7.2 m 45.07 18.57 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 179.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' B' ' 92' ' ' VAL . 0.0 OUTLIER 61.68 23.04 13.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.893 0.378 . . . . 0.0 110.815 -179.585 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . 53.01 68.35 0.85 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.999 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.652 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -138.99 57.08 10.18 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.559 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.5 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 32.1 Cg_exo -59.82 -48.15 13.58 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.428 2.085 . . . . 0.0 112.668 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.488 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 62.6 Cg_endo -90.55 29.39 0.39 Allowed 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.766 2.311 . . . . 0.0 112.78 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.652 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.2 OUTLIER -96.16 -27.05 15.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.19 -179.795 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -58.46 -51.83 68.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.034 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.32 29.71 0.9 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.372 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.848 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.774 0.321 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.413 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 0.3 OUTLIER 179.79 -51.33 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.039 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 23.9 Cg_exo -68.49 -132.65 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 123.006 2.471 . . . . 0.0 111.953 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.576 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.7 OUTLIER 175.32 150.78 0.11 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.389 0.614 . . . . 0.0 110.985 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.8 -49.23 10.85 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.442 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.812 HG23 ' CG1' ' B' ' 16' ' ' VAL . 3.9 m -64.12 -32.44 74.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.482 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.576 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.65 61.64 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.34 179.787 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' O ' ' OG ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -74.79 -26.86 60.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.372 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.566 ' HB3' HD22 ' B' ' 13' ' ' LEU . 73.7 m -68.14 -53.9 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.511 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.129 HG22 HD11 ' A' ' 14' ' ' ILE . 1.8 mp -50.77 -56.36 4.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.837 0.351 . . . . 0.0 111.355 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.822 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.9 OUTLIER -53.88 -27.78 32.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.886 -179.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.9 OUTLIER -61.8 -55.61 28.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.268 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.047 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.75 55.93 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.129 HD11 HG22 ' A' ' 10' ' ' ILE . 5.3 mt -49.79 -29.29 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.103 0.478 . . . . 0.0 112.18 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.3 -31.75 21.43 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.842 -175.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.047 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.6 m -53.32 -33.71 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.759 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.8 -56.44 4.13 Favored 'General case' 0 N--CA 1.46 0.06 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.79 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 8.6 mm-40 -48.54 -26.05 2.0 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.461 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.24 -50.71 69.12 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.627 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -80.37 -50.4 10.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.947 0.879 . . . . 0.0 109.805 178.533 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.616 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -61.58 -52.14 65.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.929 -1.487 . . . . 0.0 112.167 -178.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.17 -92.96 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 68.15 -68.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.734 0.302 . . . . 0.0 111.008 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -147.09 133.14 19.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.23 -28.54 12.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.471 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.98 83.53 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.786 0.327 . . . . 0.0 110.895 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.14 167.81 9.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.76 HG12 ' O ' ' B' ' 90' ' ' SER . 29.6 m -98.21 26.52 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.25 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.616 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 8.5 p -149.22 -177.58 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.975 0.417 . . . . 0.0 111.15 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.627 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -141.55 -124.95 0.1 Allowed 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.117 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.599 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -171.44 128.48 0.68 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.429 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.571 ' HG2' ' HE1' ' A' ' 60' ' ' MET . 19.6 mtmm -49.64 -41.17 41.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.858 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.643 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.2 m -74.65 -41.68 59.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.164 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.455 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.6 mt-10 -55.74 -28.84 57.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -26.91 59.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.236 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -61.19 -59.15 5.77 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.488 0.661 . . . . 0.0 111.672 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.8 p -64.6 -51.16 64.15 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.611 -178.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.556 ' CG ' ' CD1' ' A' ' 20' ' ' TYR . 7.7 m-85 -58.05 -50.88 71.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.979 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.798 ' HG2' HG21 ' A' ' 47' ' ' THR . 3.3 ttm -58.62 -26.98 64.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.747 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 13.3 m-20 -73.25 -19.46 61.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.675 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.73 -79.96 0.59 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.511 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.66 -46.22 63.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.871 -0.604 . . . . 0.0 112.234 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.721 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -111.21 38.46 2.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.0 110.318 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.747 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -76.1 -30.32 58.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.774 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.28 -25.15 13.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.987 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.5 m-85 -109.39 23.65 14.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.011 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.798 HG21 ' HG2' ' A' ' 39' ' ' MET . 4.2 t -179.73 39.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.87 0.367 . . . . 0.0 110.972 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HB3' ' HB1' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -118.19 -35.84 3.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.07 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -163.04 30.81 0.09 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.85 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -71.33 158.47 36.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.832 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -28.29 65.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.999 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.612 ' HB3' HG23 ' A' ' 55' ' ' VAL . 0.5 OUTLIER -112.79 106.39 55.37 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -81.42 8.16 4.56 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.523 2.149 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.01 -3.01 36.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.852 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.612 HG23 ' HB3' ' A' ' 52' ' ' ASP . 95.7 t -55.35 -53.29 37.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-O 120.694 0.283 . . . . 0.0 111.229 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.856 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -67.37 -52.29 41.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.163 0.506 . . . . 0.0 110.663 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.856 ' N ' HD23 ' A' ' 56' ' ' LEU . 3.8 t0 -59.07 -26.8 64.95 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.678 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.432 ' HA ' ' HG3' ' A' ' 61' ' ' LYS . 8.4 mmt85 -64.85 -43.26 93.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.917 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -60.87 -53.29 59.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.892 0.377 . . . . 0.0 111.522 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.86 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -73.42 -31.68 63.98 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.031 -177.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.493 ' HG3' ' H ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -78.14 -51.57 10.04 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.493 ' H ' ' HG3' ' A' ' 61' ' ' LYS . 8.5 tmtm? -81.74 4.17 22.95 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.828 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.86 HD22 ' O ' ' A' ' 60' ' ' MET . 1.1 pt? -44.36 -30.08 0.78 Allowed 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.742 ' H ' HD23 ' A' ' 63' ' ' LEU . 30.9 t70 32.35 37.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.264 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.762 HD22 ' O ' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -159.88 24.21 0.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.152 -179.831 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.768 ' HB3' HD11 ' A' ' 63' ' ' LEU . 53.4 p30 -60.93 -173.84 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.854 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.9 m -176.94 134.33 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.776 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -55.89 -23.4 31.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.935 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.65 -90.9 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.573 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.626 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.5 OUTLIER -149.39 -170.1 3.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.575 0.226 . . . . 0.0 111.021 -179.797 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.702 HD12 ' HD1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -61.32 -129.61 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 9.4 t70 166.72 159.56 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.941 0.791 . . . . 0.0 111.226 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.786 ' CG ' HG11 ' B' ' 85' ' ' VAL . 27.8 p90 -50.22 -58.65 5.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.519 -0.764 . . . . 0.0 113.004 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.5 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 37.0 tp60 -76.94 -29.29 55.57 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.278 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.736 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.97 -49.19 11.32 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.549 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.702 ' HD1' HD12 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -64.95 -54.91 23.12 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.621 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HG ' ' CZ ' ' A' ' 17' ' ' PHE . 5.7 mt -53.88 -33.98 58.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.2 0.524 . . . . 0.0 110.019 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.448 ' ND2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -76.15 -31.67 58.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.794 HD13 ' CG ' ' A' ' 59' ' ' MET . 0.2 OUTLIER -70.36 -57.95 4.28 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.896 179.885 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.082 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.17 -42.8 58.4 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.114 0 CA-C-O 120.721 0.296 . . . . 0.0 110.434 178.424 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.74 -50.7 48.51 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.204 -0.998 . . . . 0.0 110.736 179.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -52.66 -36.7 49.28 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.768 178.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.917 HD21 ' HE3' ' A' ' 59' ' ' MET . 7.1 mt -63.64 -45.79 88.59 Favored 'General case' 0 CA--C 1.518 -0.27 0 O-C-N 122.692 -0.299 . . . . 0.0 110.452 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 88' ' ' HIS . . . -54.97 -32.02 61.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.32 0.581 . . . . 0.0 110.413 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.785 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.45 -17.58 9.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.347 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.84 13.66 17.21 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.379 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 1.7 t -154.4 -42.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.897 -179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.876 ' CD2' HD13 ' B' ' 14' ' ' ILE . 39.6 t60 -87.67 150.19 23.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.927 0.394 . . . . 0.0 110.712 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.69 110.51 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.215 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.757 ' O ' HG12 ' B' ' 28' ' ' VAL . 1.3 m -178.94 -62.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.7 m-85 -115.11 -32.85 5.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.157 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t -44.54 139.01 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.593 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.22 39.87 9.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.872 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -167.76 -41.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.316 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.763 ' HB3' ' HD3' ' A' ' 96' ' ' PRO . . . -78.8 -53.14 1.21 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.486 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.763 ' HD3' ' HB3' ' A' ' 95' ' ' ALA . 75.5 Cg_exo -52.18 -47.76 25.14 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.666 2.244 . . . . 0.0 112.938 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 52.8 Cg_endo -69.5 -22.24 33.57 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.105 1.87 . . . . 0.0 112.511 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.59 117.61 16.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.861 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.15 -50.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.907 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -175.98 -51.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.928 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.854 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.824 0.345 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.419 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 0.3 OUTLIER 179.75 -51.33 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.066 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 23.9 Cg_exo -68.54 -132.6 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.041 2.494 . . . . 0.0 111.915 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.568 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.7 OUTLIER 175.24 150.73 0.11 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.436 0.636 . . . . 0.0 110.974 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.79 -49.22 10.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.395 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.832 HG23 ' CG1' ' A' ' 16' ' ' VAL . 4.0 m -64.14 -32.51 74.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.414 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.568 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.13 -40.57 61.53 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.376 179.815 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' B' ' 12' ' ' SER . 0.0 OUTLIER -74.78 -26.84 60.03 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.44 179.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.57 ' HB3' HD22 ' A' ' 13' ' ' LEU . 73.7 m -68.17 -53.9 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.508 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.082 HG12 HD11 ' A' ' 80' ' ' ILE . 1.8 mp -50.71 -56.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.889 0.376 . . . . 0.0 111.339 -179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.9 OUTLIER -53.91 -27.73 32.41 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.864 -179.338 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.452 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.9 OUTLIER -61.9 -55.59 28.12 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 1.052 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -70.17 -48.77 55.86 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.047 HD11 HG22 ' B' ' 10' ' ' ILE . 5.2 mt -49.65 -29.4 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.686 0 CA-C-O 121.09 0.471 . . . . 0.0 112.162 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.2 -31.86 21.52 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.827 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 1.052 HG22 ' O ' ' B' ' 13' ' ' LEU . 15.6 m -53.23 -33.86 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 177.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.747 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.74 -56.48 4.11 Favored 'General case' 0 C--O 1.23 0.044 0 CA-C-N 114.349 -1.296 . . . . 0.0 110.809 179.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.855 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 8.7 mm-40 -48.49 -26.12 2.0 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.442 -179.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -50.72 69.21 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.623 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -80.35 -50.38 10.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.919 0.866 . . . . 0.0 109.859 178.481 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -61.6 -52.11 65.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.888 -1.506 . . . . 0.0 112.173 -178.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.19 -92.95 0.14 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.44 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt 68.17 -68.35 0.17 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.851 0.358 . . . . 0.0 111.059 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -147.02 133.15 19.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.786 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.09 -28.44 12.85 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.511 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.89 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.847 0.356 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.16 167.81 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.876 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.757 HG12 ' O ' ' A' ' 90' ' ' SER . 29.9 m -98.15 26.37 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.285 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.62 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 8.1 p -149.2 -177.59 5.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.958 0.409 . . . . 0.0 111.119 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.623 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -141.49 -124.96 0.1 Allowed 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.129 -179.704 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.603 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -171.45 128.6 0.68 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.393 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.534 ' HG2' ' HE1' ' B' ' 60' ' ' MET . 19.6 mtmm -49.68 -41.18 42.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.2 m -74.64 -41.73 59.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.153 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.6 mt-10 -55.75 -28.8 57.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.948 0.404 . . . . 0.0 110.376 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.36 -26.82 58.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.171 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.2 mm? -61.22 -59.16 5.75 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.568 0.699 . . . . 0.0 111.717 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 46.6 p -64.49 -51.15 64.43 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.694 -178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.555 ' CG ' ' CD1' ' B' ' 20' ' ' TYR . 7.8 m-85 -58.09 -50.87 71.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.99 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.771 ' HG2' HG21 ' B' ' 47' ' ' THR . 3.3 ttm -58.64 -27.06 64.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 0.0 110.5 179.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.74 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 13.6 m-20 -73.16 -19.39 61.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.79 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -112.77 -79.92 0.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.567 -179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -51.62 -46.33 63.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.13 -179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.719 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -111.2 38.49 2.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.272 0.558 . . . . 0.0 110.292 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.74 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -76.11 -30.27 58.18 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.826 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.29 -25.19 13.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.991 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.426 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.5 m-85 -109.44 23.76 14.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.006 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.771 HG21 ' HG2' ' B' ' 39' ' ' MET . 4.2 t -179.78 39.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.913 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.509 ' HB3' ' HB1' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -118.21 -35.85 3.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 -179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -163.09 30.76 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.883 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -71.28 158.47 36.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.42 -28.38 65.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.962 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.625 ' HB3' HG23 ' B' ' 55' ' ' VAL . 0.5 OUTLIER -112.71 106.45 55.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.811 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -81.42 8.06 4.62 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.536 2.157 . . . . 0.0 112.846 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -106.97 -2.97 36.47 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.896 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.625 HG23 ' HB3' ' B' ' 52' ' ' ASP . 94.3 t -55.36 -53.27 37.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 120.711 0.291 . . . . 0.0 111.286 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.849 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -67.35 -52.31 41.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.126 0.489 . . . . 0.0 110.654 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.849 ' N ' HD23 ' B' ' 56' ' ' LEU . 3.8 t0 -59.01 -26.95 64.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.667 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.411 ' HA ' ' HG3' ' B' ' 61' ' ' LYS . 8.4 mmt85 -64.7 -43.23 94.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.051 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.991 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -60.94 -53.35 58.32 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.931 0.396 . . . . 0.0 111.455 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.859 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -73.39 -31.7 64.04 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.017 -177.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.476 ' HG3' ' H ' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -78.12 -51.51 10.15 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.838 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.476 ' H ' ' HG3' ' B' ' 61' ' ' LYS . 8.5 tmtm? -81.78 4.12 23.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.8 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.859 HD22 ' O ' ' B' ' 60' ' ' MET . 1.1 pt? -44.39 -30.07 0.78 Allowed 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.721 ' H ' HD23 ' B' ' 63' ' ' LEU . 31.0 t70 32.37 37.68 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.498 . . . . 0.0 112.289 179.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.756 HD22 ' O ' ' B' ' 63' ' ' LEU . 0.6 OUTLIER -159.81 24.07 0.18 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.213 -179.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . 0.756 ' HB3' HD11 ' B' ' 63' ' ' LEU . 53.5 p30 -60.8 -173.83 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.874 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 2.9 m -176.89 134.29 0.2 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.834 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -55.92 -23.33 30.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.947 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.73 -90.92 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.536 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.618 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.5 OUTLIER -149.33 -170.15 3.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.54 0.21 . . . . 0.0 111.039 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.737 HD12 ' HD1' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -61.28 -129.62 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 9.4 t70 166.76 159.58 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.995 0.816 . . . . 0.0 111.27 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.785 ' CG ' HG11 ' A' ' 85' ' ' VAL . 27.5 p90 -50.2 -58.71 5.01 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.951 -179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.49 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 36.9 tp60 -76.95 -29.22 55.5 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.326 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.722 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.92 -49.2 11.16 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.488 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.737 ' HD1' HD12 ' B' ' 71' ' ' LEU . 0.1 OUTLIER -65.01 -54.85 23.86 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.616 179.281 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.485 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 5.6 mt -53.88 -34.0 58.15 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.159 0.504 . . . . 0.0 110.031 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.452 ' ND2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -76.06 -31.71 58.94 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 177.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.8 HD13 ' CG ' ' B' ' 59' ' ' MET . 0.2 OUTLIER -70.3 -57.92 4.33 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.977 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 1.006 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.18 -42.83 58.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-O 120.713 0.292 . . . . 0.0 110.38 178.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.63 49.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.167 -1.016 . . . . 0.0 110.758 179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.481 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -52.73 -36.63 49.68 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.719 178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.991 HD21 ' HE3' ' B' ' 59' ' ' MET . 7.1 mt -63.64 -45.9 88.14 Favored 'General case' 0 CA--C 1.518 -0.28 0 O-C-N 122.698 -0.295 . . . . 0.0 110.449 179.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' B' ' 88' ' ' HIS . . . -54.97 -32.0 61.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.295 0.569 . . . . 0.0 110.429 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.786 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.63 9.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.443 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -114.81 13.67 17.24 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.307 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.433 ' N ' ' O ' ' B' ' 83' ' ' LEU . 1.7 t -154.4 -42.38 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.905 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.888 ' CD2' HD13 ' A' ' 14' ' ' ILE . 39.5 t60 -87.67 150.08 23.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.822 0.344 . . . . 0.0 110.754 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.65 110.61 0.53 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.23 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.76 ' O ' HG12 ' A' ' 28' ' ' VAL . 1.3 m -178.94 -62.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.851 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.625 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.7 m-85 -115.15 -32.8 5.57 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.057 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 21.8 t -44.59 139.06 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.501 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.17 39.87 9.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.891 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -167.73 -41.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.399 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.771 ' HB3' ' HD3' ' B' ' 96' ' ' PRO . . . -78.78 -53.13 1.22 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.535 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.771 ' HD3' ' HB3' ' B' ' 95' ' ' ALA . 75.1 Cg_exo -52.3 -47.65 25.81 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.626 2.218 . . . . 0.0 112.935 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 53.2 Cg_endo -69.53 -22.24 33.43 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.15 1.9 . . . . 0.0 112.512 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.64 117.7 16.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.874 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.16 -50.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.991 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -176.0 -51.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.855 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.864 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.86 0.362 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 7' ' ' GLU . 0.5 OUTLIER -179.55 -50.16 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.114 179.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 13.2 Cg_exo -77.29 19.44 0.71 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 123.434 2.756 . . . . 0.0 113.388 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.677 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -61.59 143.56 55.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.394 0.616 . . . . 0.0 111.23 -179.304 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.49 -42.0 6.79 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.43 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.979 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.5 OUTLIER -72.17 -41.74 66.69 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 109.998 179.188 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.677 ' HB2' HG23 ' A' ' 4' ' ' THR . 4.5 mm-40 -51.97 -45.85 64.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.984 0.421 . . . . 0.0 109.92 179.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -73.58 -26.62 60.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.584 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -64.55 -41.15 96.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.527 -179.507 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.979 HD12 ' O ' ' A' ' 6' ' ' THR . 3.4 mp -73.8 -51.31 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.955 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.2 OUTLIER -51.83 -27.29 12.03 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.641 0.238 . . . . 0.0 111.641 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.578 ' O ' HG13 ' A' ' 16' ' ' VAL . 1.4 t -76.67 -55.73 5.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.585 -0.28 . . . . 0.0 111.653 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.847 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.48 65.16 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.955 HD12 ' HA ' ' A' ' 11' ' ' GLU . 20.1 mt -69.96 -41.53 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.865 0 CA-C-O 121.766 0.793 . . . . 0.0 110.741 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.636 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -73.99 -37.82 64.31 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 113.621 -1.627 . . . . 0.0 112.512 -175.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.847 HG22 ' O ' ' A' ' 13' ' ' LEU . 21.1 m -52.51 -36.99 22.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.617 0 CA-C-O 121.731 0.777 . . . . 0.0 109.072 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.501 ' N ' HG23 ' A' ' 16' ' ' VAL . 2.9 t80 -80.52 -57.06 3.76 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 114.418 -1.265 . . . . 0.0 113.221 -178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.887 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -70.55 -24.48 62.8 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -177.485 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -52.16 64.19 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.415 -179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.629 ' OH ' HG21 ' A' ' 41' ' ' THR . 4.6 m-85 -80.51 -38.45 29.75 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.763 0.792 . . . . 0.0 109.473 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.887 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.16 -26.62 64.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.746 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -101.46 -104.12 2.72 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.519 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.2 73.02 0.48 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 110.781 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.27 37.25 14.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.74 104.32 0.21 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.556 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -70.9 139.47 50.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.85 0.357 . . . . 0.0 110.933 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.2 p -175.69 165.67 3.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.8 m -107.3 31.96 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.675 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 18.1 p -155.33 -178.34 7.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.806 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -136.82 -123.86 0.14 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.101 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.57 ' N ' HD22 ' A' ' 30' ' ' LEU . 5.3 t -175.68 130.33 0.26 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.65 -41.41 42.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.011 0.434 . . . . 0.0 110.474 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 0.9 OUTLIER -61.95 -50.35 72.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.313 179.317 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.432 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -57.8 -37.13 73.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.551 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -73.4 -31.03 63.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.272 178.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -58.76 -59.36 5.54 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.454 0.645 . . . . 0.0 110.217 179.112 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.703 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -61.18 -26.94 68.06 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.672 179.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.513 ' CD2' ' CE1' ' A' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.59 85.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.746 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.47 ' HA ' ' CB ' ' A' ' 43' ' ' LEU . 1.1 mtp -69.11 -35.23 76.21 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.133 0.492 . . . . 0.0 110.354 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.5 -19.24 60.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.879 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.809 HG23 ' HG2' ' A' ' 42' ' ' GLU . 6.3 t -110.38 -37.27 5.56 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.809 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.7 mm-40 -128.16 -27.01 2.77 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -176.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.707 HD21 HD11 ' B' ' 10' ' ' ILE . 5.1 mt -112.07 44.29 1.43 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.526 0.679 . . . . 0.0 109.718 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -78.68 -25.63 44.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.906 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.38 -23.41 65.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.444 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.573 ' CD1' HD22 ' A' ' 43' ' ' LEU . 3.9 m-85 -86.11 -32.33 21.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.542 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.9 p -86.1 -34.14 20.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.177 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -58.87 -78.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.859 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.25 55.91 3.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.583 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -59.66 -50.48 73.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.064 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 25.2 tttt 56.29 24.26 8.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.466 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -177.22 120.9 0.27 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.508 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -83.13 15.98 1.97 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.564 2.176 . . . . 0.0 112.825 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.429 ' O ' ' CB ' ' A' ' 58' ' ' ARG . . . -118.02 9.84 13.82 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.624 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.757 HG22 ' HB1' ' A' ' 86' ' ' ALA . 68.0 t -84.64 -64.63 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.027 0.442 . . . . 0.0 111.072 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.01 -51.69 10.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.099 -179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 29.2 t70 -59.85 -35.76 75.42 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 54' ' ' GLY . 3.2 tpm_? -58.77 -52.3 66.3 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -178.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.656 ' HE1' ' O ' ' A' ' 79' ' ' LEU . 0.0 OUTLIER -75.34 -54.17 7.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.86 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -53.12 -29.81 33.07 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -78.75 -61.19 2.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.897 0.38 . . . . 0.0 111.136 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 6.18 13.01 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.094 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.86 HD22 ' O ' ' A' ' 60' ' ' MET . 1.4 pt? -47.17 -22.84 0.42 Allowed 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.496 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.494 ' H ' HD23 ' A' ' 63' ' ' LEU . 1.0 OUTLIER 76.65 52.91 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.977 0.417 . . . . 0.0 110.8 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.666 HD23 ' HG ' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -118.3 60.67 0.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.399 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -80.95 57.0 2.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.106 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.7 m 46.35 29.67 0.9 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.333 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.53 27.42 3.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.609 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 140.79 -101.23 0.29 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.481 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.637 ' C ' HD11 ' A' ' 65' ' ' LEU . 8.5 mm100 -166.47 -167.83 1.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.723 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -62.42 -133.91 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.492 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 4.6 t0 177.19 -178.95 0.19 Allowed 'General case' 0 N--CA 1.461 0.1 0 O-C-N 121.811 -0.556 . . . . 0.0 110.985 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.837 ' CD2' HG21 ' B' ' 85' ' ' VAL . 44.1 p90 -69.22 -55.89 9.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.328 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.566 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -80.5 -26.3 38.26 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.74 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.723 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.1 OUTLIER -44.62 -35.94 2.83 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.274 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.525 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 2.1 t80 -77.87 -54.01 6.81 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.638 178.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.801 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.2 mt -57.85 -33.4 68.61 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.566 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.04 -49.23 18.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.366 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 1.058 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 5.6 mp -65.62 -61.5 2.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.863 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.57 ' CG1' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.86 -44.58 86.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.574 178.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.805 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -60.77 -50.24 69.7 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 110.156 -1.178 . . . . 0.0 110.156 178.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.565 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -58.86 -39.77 94.34 Favored Glycine 0 CA--C 1.521 0.445 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.053 178.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 1.058 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.8 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 88' ' ' HIS . . . -58.79 -41.45 86.74 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.544 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.835 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -74.22 -17.29 16.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.321 -179.139 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.757 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -109.34 17.59 21.33 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.329 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.44 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.586 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.457 ' N ' ' O ' ' A' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.71 2.53 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.465 -179.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.661 ' HG2' HG23 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -178.86 -168.84 0.14 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 111.248 -179.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' A' ' 94' ' ' ALA . 8.4 t -76.11 -27.39 57.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.661 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -53.96 52.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.757 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.49 HG12 ' NZ ' ' A' ' 99' ' ' LYS . 19.1 m -82.77 -24.75 8.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.248 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.11 -13.36 55.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.417 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 90' ' ' SER . . . -82.15 -38.39 24.77 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.72 0.295 . . . . 0.0 111.193 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.706 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -133.01 52.56 8.94 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.284 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.485 ' HG2' ' HD3' ' A' ' 97' ' ' PRO . 1.1 Cg_endo -40.62 -58.42 0.99 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.364 2.709 . . . . 0.0 112.967 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.485 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 58.1 Cg_endo -70.39 -34.36 12.62 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.293 1.996 . . . . 0.0 112.02 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.706 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 5.8 mt-30 -79.15 103.56 9.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.873 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.49 ' NZ ' HG12 ' A' ' 92' ' ' VAL . 0.1 OUTLIER -142.44 -44.3 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.928 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -51.13 164.37 0.17 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.113 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.906 -179.961 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.433 ' O ' ' CB ' ' B' ' 7' ' ' GLU . 0.5 OUTLIER -179.54 -50.05 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.118 179.897 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 13.2 Cg_exo -77.43 19.56 0.72 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.418 2.745 . . . . 0.0 113.326 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.702 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER -61.78 143.51 56.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.43 0.633 . . . . 0.0 111.223 -179.314 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -44.44 -42.03 6.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.339 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.972 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.5 OUTLIER -72.1 -41.85 66.81 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.002 0.429 . . . . 0.0 109.989 179.197 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.702 ' HB2' HG23 ' B' ' 4' ' ' THR . 4.5 mm-40 -51.86 -45.82 64.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.021 0.439 . . . . 0.0 109.931 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 6.1 mtp180 -73.59 -26.67 60.92 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.611 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 0.6 OUTLIER -64.58 -41.03 96.54 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.597 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 0.972 HD12 ' O ' ' B' ' 6' ' ' THR . 3.4 mp -73.92 -51.32 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.839 -179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 1.012 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.2 OUTLIER -51.88 -27.17 11.91 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.579 ' O ' HG13 ' B' ' 16' ' ' VAL . 1.4 t -76.78 -55.75 5.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.523 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.822 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.2 mm? -58.84 -27.44 65.13 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.012 HD12 ' HA ' ' B' ' 11' ' ' GLU . 20.2 mt -69.94 -41.48 79.49 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.876 0 CA-C-O 121.878 0.847 . . . . 0.0 110.838 178.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . 0.636 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -74.05 -37.82 64.16 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 113.513 -1.676 . . . . 0.0 112.523 -175.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.822 HG22 ' O ' ' B' ' 13' ' ' LEU . 21.0 m -52.44 -36.97 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-O 121.718 0.77 . . . . 0.0 109.092 177.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.488 ' N ' HG23 ' B' ' 16' ' ' VAL . 2.9 t80 -80.44 -57.24 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.462 -1.245 . . . . 0.0 113.232 -178.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.903 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.8 OUTLIER -70.46 -24.49 62.89 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -177.456 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.2 -52.17 64.2 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.346 -0.542 . . . . 0.0 110.378 -179.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.62 ' OH ' HG21 ' B' ' 41' ' ' THR . 4.6 m-85 -80.53 -38.44 29.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.796 0.808 . . . . 0.0 109.421 177.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.903 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.23 -26.57 65.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.746 -179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -101.47 -104.1 2.72 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.565 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.14 73.01 0.48 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.849 0.357 . . . . 0.0 110.798 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 62.38 37.2 13.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.813 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -168.76 104.39 0.21 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.435 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -70.92 139.49 50.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 110.965 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 16.8 p -175.72 165.76 3.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 23.5 m -107.39 31.88 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.088 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.679 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 18.0 p -155.32 -178.37 7.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.649 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -136.78 -123.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.151 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.565 ' N ' HD22 ' B' ' 30' ' ' LEU . 5.3 t -175.66 130.28 0.26 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 120.675 0.274 . . . . 0.0 110.281 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -41.32 41.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 0.0 110.503 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 0.9 OUTLIER -62.07 -50.32 72.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.293 179.267 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.435 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 0.5 OUTLIER -57.85 -37.07 73.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.279 0.561 . . . . 0.0 109.6 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -73.38 -31.07 63.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.505 -0.771 . . . . 0.0 109.274 178.234 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' B' ' 33' ' ' THR . 0.1 OUTLIER -58.79 -59.32 5.61 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.463 0.649 . . . . 0.0 110.226 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.694 ' O ' HG22 ' B' ' 41' ' ' THR . 0.3 OUTLIER -61.25 -26.9 68.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.659 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.503 ' CD2' ' CE1' ' B' ' 20' ' ' TYR . 2.0 t80 -57.98 -42.53 85.28 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.748 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.556 ' HE3' ' HB3' ' B' ' 43' ' ' LEU . 1.1 mtp -69.2 -35.09 75.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.09 0.471 . . . . 0.0 110.369 179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -73.56 -19.22 60.95 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.9 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.79 HG23 ' HG2' ' B' ' 42' ' ' GLU . 6.3 t -110.46 -37.19 5.56 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.79 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.7 mm-40 -128.21 -27.05 2.75 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.722 HD21 HD11 ' A' ' 10' ' ' ILE . 5.1 mt -111.97 44.2 1.44 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.415 0.626 . . . . 0.0 109.707 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.42 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -78.58 -25.68 45.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.948 -179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.34 -23.43 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.588 ' CD1' HD22 ' B' ' 43' ' ' LEU . 3.9 m-85 -86.05 -32.38 21.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.644 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.8 p -86.1 -34.18 20.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -58.94 -78.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.828 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -86.26 55.85 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.464 . . . . 0.0 110.579 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' B' ' 46' ' ' PHE . 1.7 mm-40 -59.56 -50.48 73.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.115 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 25.1 tttt 56.31 24.18 8.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.464 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -177.19 120.9 0.27 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.525 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -83.12 15.95 1.98 Allowed 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.593 2.196 . . . . 0.0 112.759 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' B' ' 58' ' ' ARG . . . -118.09 9.94 13.66 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.56 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.761 HG22 ' HB1' ' B' ' 86' ' ' ALA . 67.3 t -84.71 -64.56 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.976 0.417 . . . . 0.0 111.163 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 5.5 tp -76.94 -51.84 10.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.093 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.516 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 29.2 t70 -59.74 -35.79 75.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.673 -178.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.428 ' CB ' ' O ' ' B' ' 54' ' ' GLY . 3.2 tpm_? -58.77 -52.36 66.04 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.661 ' HE1' ' O ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -75.33 -54.12 7.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.885 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -53.14 -29.78 33.24 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.585 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -78.7 -61.2 2.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 0.0 111.207 179.438 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.44 6.2 12.95 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.167 -179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.885 HD22 ' O ' ' B' ' 60' ' ' MET . 1.4 pt? -47.19 -22.81 0.43 Allowed 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.501 ' H ' HD23 ' B' ' 63' ' ' LEU . 1.0 OUTLIER 76.58 52.93 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.956 0.408 . . . . 0.0 110.793 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.664 HD23 ' HG ' ' B' ' 63' ' ' LEU . 0.6 OUTLIER -118.23 60.74 0.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.4 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.98 56.89 2.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.092 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.7 m 46.37 29.62 0.9 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.395 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -96.41 27.33 3.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.693 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.4 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . 140.77 -101.22 0.29 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.477 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.636 ' C ' HD11 ' B' ' 65' ' ' LEU . 8.4 mm100 -166.54 -167.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.588 0.232 . . . . 0.0 110.414 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.71 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -62.55 -133.86 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.465 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 4.5 t0 177.2 -179.0 0.19 Allowed 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 118.473 0.579 . . . . 0.0 111.101 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.835 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.8 p90 -69.07 -56.01 9.01 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.384 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.539 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -80.45 -26.24 38.46 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.821 -179.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.721 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.66 -35.92 2.85 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.342 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.517 ' CZ ' ' CE1' ' B' ' 35' ' ' PHE . 2.1 t80 -77.8 -54.15 6.67 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.629 178.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.805 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.2 mt -57.72 -33.58 68.57 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.539 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.1 OUTLIER -75.84 -49.34 18.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 1.068 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 5.6 mp -65.63 -61.43 2.09 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.872 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.564 HD11 ' CG1' ' A' ' 10' ' ' ILE . 0.1 OUTLIER -57.87 -44.54 86.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.585 178.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.801 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -60.78 -50.35 68.58 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.569 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -58.79 -39.68 94.07 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.189 178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 1.068 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 17.8 mt -62.97 -38.86 92.81 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.496 ' O ' ' N ' ' B' ' 88' ' ' HIS . . . -58.78 -41.44 86.66 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.64 178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.837 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -74.16 -17.39 16.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.404 -179.259 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.761 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -109.25 17.67 21.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.458 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 12.1 t -160.45 -39.61 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.526 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.496 ' N ' ' O ' ' B' ' 84' ' ' ALA . 0.2 OUTLIER -139.25 91.74 2.53 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.439 -179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.63 ' HG2' HG23 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -178.88 -168.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.322 -179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.412 ' O ' ' HB2' ' B' ' 94' ' ' ALA . 8.4 t -76.12 -27.33 57.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.649 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.03 -53.89 53.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.812 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.496 HG12 ' NZ ' ' B' ' 99' ' ' LYS . 19.1 m -82.78 -24.74 8.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.269 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -83.12 -13.36 55.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.481 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' B' ' 90' ' ' SER . . . -82.11 -38.36 24.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.776 0.322 . . . . 0.0 111.294 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.703 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -132.98 52.56 8.96 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.326 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.477 ' HG2' ' HD3' ' B' ' 97' ' ' PRO . 1.1 Cg_endo -40.7 -58.34 1.02 Allowed 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 123.408 2.739 . . . . 0.0 112.999 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.477 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 57.8 Cg_endo -70.42 -34.29 12.64 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.321 2.014 . . . . 0.0 112.091 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.703 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 5.9 mt-30 -79.15 103.58 9.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.85 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . 0.496 ' NZ ' HG12 ' B' ' 92' ' ' VAL . 0.1 OUTLIER -142.47 -44.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.985 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -51.13 164.34 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.132 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.929 -179.894 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.7 p . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.857 0.36 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.471 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -128.22 143.19 47.12 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.852 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 2' ' ' ARG . 38.5 Cg_exo -65.16 -128.88 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 122.976 2.45 . . . . 0.0 111.943 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.638 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -165.85 149.81 8.03 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.397 0.618 . . . . 0.0 110.865 -179.85 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.9 -47.64 11.21 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.528 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.91 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.6 m -66.79 -34.77 78.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.628 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.638 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.59 -39.19 57.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.704 -179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.11 -26.67 60.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.965 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.624 ' HB3' HD22 ' B' ' 13' ' ' LEU . 76.3 m -69.8 -52.65 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.256 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.034 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -58.26 -56.65 14.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.923 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.56 -27.07 15.17 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.518 -179.627 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -64.39 -55.88 18.05 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -178.907 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.959 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -74.25 -27.28 60.68 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.034 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -66.73 -35.95 76.05 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.833 0 O-C-N 121.73 -0.606 . . . . 0.0 110.824 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.86 61.17 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.259 -1.337 . . . . 0.0 112.25 -176.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.959 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -53.84 -36.18 29.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.471 0.653 . . . . 0.0 109.74 178.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.529 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -80.17 -60.04 2.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.725 -178.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.987 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -66.7 -28.64 68.6 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.11 -50.99 57.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.948 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.479 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -79.67 -31.84 41.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.583 0.706 . . . . 0.0 109.562 178.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -71.55 -6.99 44.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 114.737 -1.12 . . . . 0.0 112.003 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.414 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -88.11 -169.69 45.37 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.501 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 mttt 59.82 63.89 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 0.0 110.908 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.42 -72.5 0.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.872 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.14 -89.06 0.11 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.591 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -100.78 166.17 11.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.792 0.33 . . . . 0.0 110.853 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.6 p 58.24 167.68 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.869 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' A' ' 29' ' ' THR . 3.3 m -107.75 -115.63 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.655 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 3.0 p 54.09 163.22 0.01 OUTLIER 'General case' 0 C--N 1.339 0.143 0 CA-C-O 121.26 0.553 . . . . 0.0 111.637 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -114.98 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.13 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.523 ' N ' HD22 ' A' ' 30' ' ' LEU . 14.0 t 175.33 130.03 0.03 OUTLIER 'General case' 0 C--O 1.231 0.113 0 O-C-N 122.21 -0.306 . . . . 0.0 110.387 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -32.38 32.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.987 0.422 . . . . 0.0 110.757 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.588 ' HA ' HD12 ' A' ' 36' ' ' LEU . 1.0 OUTLIER -68.15 -48.61 64.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.024 179.291 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -28.74 70.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.517 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -70.8 -33.36 70.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.6 178.498 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.77 -59.73 4.97 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-O 121.502 0.668 . . . . 0.0 111.137 179.881 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.0 m -59.54 -34.02 72.13 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.06 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.461 ' CE1' ' CB ' ' A' ' 42' ' ' GLU . 72.8 t80 -60.07 -55.02 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.676 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -58.57 -28.93 66.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.007 0.432 . . . . 0.0 110.571 179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.81 -19.77 60.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.875 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.88 -80.95 0.63 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.461 ' CB ' ' CE1' ' A' ' 38' ' ' PHE . 2.3 mm-40 -55.59 -24.31 32.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.46 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.957 HD21 HD11 ' B' ' 10' ' ' ILE . 11.4 mt -135.04 48.76 2.25 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.024 0.44 . . . . 0.0 110.838 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.41 -28.15 62.8 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.325 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.85 -24.75 62.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.636 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.623 ' HD2' HD22 ' A' ' 43' ' ' LEU . 66.8 m-85 -102.26 26.9 7.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.868 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.567 HG21 ' HG2' ' A' ' 39' ' ' MET . 5.0 t 179.25 38.27 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.773 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.401 ' HE2' ' HB2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER -103.06 -37.1 7.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.988 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.401 ' HB2' ' HE2' ' A' ' 48' ' ' LYS . 2.7 t-20 -113.12 -13.31 13.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.039 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 55.9 56.94 5.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 111.183 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -68.14 -32.92 73.54 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.502 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -133.17 71.08 77.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.625 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.64 118.31 4.57 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.494 2.129 . . . . 0.0 112.219 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.472 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . 134.97 -35.38 2.2 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.29 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.663 HG12 HD22 ' A' ' 83' ' ' LEU . 94.2 t -47.72 -53.58 4.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.91 0.386 . . . . 0.0 111.032 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.713 HD12 ' SD ' ' A' ' 39' ' ' MET . 5.5 tt -68.46 -52.62 30.48 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.433 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.442 ' N ' HD23 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -58.02 -33.4 68.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.212 -178.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.485 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -58.86 -54.18 50.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.251 . . . . 0.0 111.56 -179.134 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.745 ' CE ' HD23 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -76.48 -42.56 43.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.55 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -73.19 -54.76 7.66 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.425 ' HG2' ' N ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -70.66 -51.75 25.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.783 0.325 . . . . 0.0 111.254 -179.254 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -80.6 7.36 10.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.304 179.511 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.76 HD23 ' H ' ' A' ' 64' ' ' ASP . 1.0 OUTLIER -44.11 -27.85 0.43 Allowed 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.18 -179.195 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.76 ' H ' HD23 ' A' ' 63' ' ' LEU . 1.2 m-20 37.85 64.57 0.66 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.842 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.641 HD21 HD12 ' A' ' 63' ' ' LEU . 68.6 mt -55.94 -70.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.904 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 43.87 29.86 0.34 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.598 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.2 t -98.44 -73.69 0.61 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.008 0.432 . . . . 0.0 110.623 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 p30 -143.41 34.47 1.31 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.198 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 63.85 35.25 91.77 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.905 -179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.437 ' HB3' ' CB ' ' A' ' 29' ' ' THR . 2.0 mm-40 -157.23 166.31 33.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.745 0.307 . . . . 0.0 111.202 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.531 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.26 -130.22 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 119.119 -0.467 . . . . 0.0 109.888 179.775 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.531 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 1.5 t0 175.31 -173.98 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.324 0.965 . . . . 0.0 112.375 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.849 ' CD2' HG21 ' B' ' 85' ' ' VAL . 43.5 p90 -83.2 -57.16 3.38 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.071 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.466 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.76 48.72 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.422 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.862 ' O ' HD23 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.61 -48.27 10.41 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.173 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.529 ' CB ' ' HB2' ' A' ' 17' ' ' PHE . 1.7 t80 -65.21 -52.95 51.49 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.298 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.425 HD21 ' HB3' ' A' ' 13' ' ' LEU . 6.1 mt -53.2 -38.96 63.33 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.145 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.407 ' CB ' HE21 ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.36 -36.61 58.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.063 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.862 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -61.5 -57.23 12.97 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.841 179.665 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.982 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.21 -44.8 30.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.802 178.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.468 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -52.75 -50.7 48.58 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -56.56 -31.26 60.07 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.225 -0.988 . . . . 0.0 111.525 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.834 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 16.6 mt -66.54 -44.77 81.49 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.73 -33.86 64.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.272 0.558 . . . . 0.0 110.776 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.855 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.96 9.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.736 -179.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.62 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -115.13 14.31 16.99 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.189 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.63 -40.54 0.05 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.399 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.507 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.7 t-160 -93.4 177.99 5.86 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-O 120.876 0.37 . . . . 0.0 111.123 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.54 93.55 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.282 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.55 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 173.92 111.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.566 ' HB2' HG12 ' A' ' 85' ' ' VAL . 1.1 t80 68.69 -67.06 0.22 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.714 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.0 p -61.56 -24.2 33.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.1 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.55 -23.31 26.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.184 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.92 19.14 9.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.464 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.785 ' HB3' ' HD3' ' A' ' 96' ' ' PRO . . . -102.46 -54.62 0.12 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.677 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.785 ' HD3' ' HB3' ' A' ' 95' ' ' ALA . 62.1 Cg_exo -54.1 -43.99 53.4 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.571 2.181 . . . . 0.0 112.892 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.486 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 97.6 Cg_endo -85.36 30.11 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.577 2.185 . . . . 0.0 112.904 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -158.64 31.32 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.76 35.1 3.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.76 -46.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.7 t80 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.927 179.956 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 32.3 p . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.843 0.354 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.464 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -128.25 143.17 47.06 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.862 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 2' ' ' ARG . 38.6 Cg_exo -65.19 -128.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.933 2.422 . . . . 0.0 111.874 -179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.632 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -165.84 149.89 8.08 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-O 121.414 0.626 . . . . 0.0 110.855 -179.869 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -44.95 -47.6 11.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.606 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.6 m -66.72 -34.79 78.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.678 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.632 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.56 -39.23 57.4 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.69 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mtt85 -74.03 -26.74 60.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.983 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.627 ' HB3' HD22 ' A' ' 13' ' ' LEU . 78.5 m -69.87 -52.59 23.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.175 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.062 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -58.27 -56.68 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.764 0.316 . . . . 0.0 111.414 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.927 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.55 -27.07 15.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.452 -179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.551 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -64.41 -55.93 17.69 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -178.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.957 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -74.11 -27.34 60.83 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.062 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -66.77 -35.97 76.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-O 121.387 0.613 . . . . 0.0 110.785 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.15 -37.8 61.19 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.228 -1.351 . . . . 0.0 112.331 -176.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.957 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.0 m -53.88 -36.12 29.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.467 0.651 . . . . 0.0 109.714 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.528 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -80.19 -60.11 2.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.865 -1.062 . . . . 0.0 112.654 -178.668 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.992 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -66.74 -28.58 68.53 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -51.06 -50.93 57.72 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.022 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.48 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -79.74 -31.81 41.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.609 0.718 . . . . 0.0 109.606 177.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.992 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -71.52 -6.98 44.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.009 -179.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -88.27 -169.6 45.2 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.545 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 mttt 59.73 64.0 1.39 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.954 0.407 . . . . 0.0 110.949 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -148.49 -72.55 0.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.861 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.18 -89.05 0.11 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.576 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -100.83 166.24 10.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 12.6 p 58.16 167.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.998 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.405 ' O ' ' O ' ' B' ' 29' ' ' THR . 3.4 m -107.75 -115.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.766 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.652 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 3.0 p 53.93 163.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.126 0 CA-C-O 121.228 0.537 . . . . 0.0 111.676 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.61 HD23 ' HA ' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -121.46 -115.04 0.31 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.108 -179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.527 ' N ' HD22 ' B' ' 30' ' ' LEU . 13.8 t 175.43 130.17 0.04 OUTLIER 'General case' 0 C--O 1.231 0.126 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.98 -32.33 33.22 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.762 -179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.595 ' HA ' HD12 ' B' ' 36' ' ' LEU . 1.0 OUTLIER -68.22 -48.58 64.76 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.952 179.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -28.65 70.02 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.522 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -70.84 -33.41 70.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.512 178.504 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.595 HD12 ' HA ' ' B' ' 33' ' ' THR . 0.2 OUTLIER -58.74 -59.72 4.96 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.431 0.634 . . . . 0.0 111.109 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 29.8 m -59.52 -34.03 72.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.924 -1.034 . . . . 0.0 111.086 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.446 ' CE1' ' CB ' ' B' ' 42' ' ' GLU . 73.1 t80 -60.09 -55.06 38.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.609 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.716 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.3 OUTLIER -58.61 -28.85 66.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.56 179.691 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -73.86 -19.72 60.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.821 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.95 -81.02 0.63 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.446 ' CB ' ' CE1' ' B' ' 38' ' ' PHE . 2.3 mm-40 -55.56 -24.24 31.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.496 -178.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.928 HD21 HD11 ' A' ' 10' ' ' ILE . 11.3 mt -135.11 48.79 2.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.794 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.47 -27.99 62.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.367 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.7 62.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.722 179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.609 ' HD2' HD22 ' B' ' 43' ' ' LEU . 67.0 m-85 -102.24 26.72 7.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.873 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.595 HG21 ' HG2' ' B' ' 39' ' ' MET . 5.0 t 179.38 38.34 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.768 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.12 -37.05 7.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.967 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -113.09 -13.33 13.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.093 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 55.87 57.05 5.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.104 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -68.24 -32.81 73.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.53 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -133.21 71.05 77.44 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.599 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.59 118.33 4.58 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.619 2.212 . . . . 0.0 112.16 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . 134.81 -35.25 2.23 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.279 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.648 HG12 HD22 ' B' ' 83' ' ' LEU . 94.6 t -47.78 -53.51 4.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.94 0.4 . . . . 0.0 111.09 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.716 HD12 ' SD ' ' B' ' 39' ' ' MET . 5.5 tt -68.59 -52.5 31.01 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.455 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.438 ' N ' HD23 ' B' ' 56' ' ' LEU . 0.4 OUTLIER -58.09 -33.35 68.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.147 -178.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.497 ' O ' ' HB2' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -58.82 -54.22 49.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.644 0.259 . . . . 0.0 111.502 -179.092 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.734 ' CE ' HD23 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -76.44 -42.63 43.35 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.545 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -73.21 -54.72 7.72 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -178.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.429 ' HG2' ' N ' ' B' ' 62' ' ' LYS . 0.0 OUTLIER -70.64 -51.76 25.8 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.677 0.275 . . . . 0.0 111.279 -179.314 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.497 ' HB2' ' O ' ' B' ' 58' ' ' ARG . 0.0 OUTLIER -80.61 7.36 10.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.301 179.487 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.762 HD23 ' H ' ' B' ' 64' ' ' ASP . 1.0 OUTLIER -44.05 -27.92 0.43 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.147 -0.479 . . . . 0.0 112.166 -179.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.762 ' H ' HD23 ' B' ' 63' ' ' LEU . 1.2 m-20 37.88 64.49 0.67 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.848 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.647 HD21 HD12 ' B' ' 63' ' ' LEU . 69.0 mt -55.9 -70.29 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.967 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 43.91 29.82 0.35 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.565 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.2 t -98.45 -73.66 0.61 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.647 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 33.5 p30 -143.49 34.64 1.3 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 63.72 35.3 91.84 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.01 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.433 ' HB3' ' CB ' ' B' ' 29' ' ' THR . 2.0 mm-40 -157.29 166.28 33.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.715 0.293 . . . . 0.0 111.227 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.53 ' HB3' ' H ' ' B' ' 72' ' ' ASP . 0.3 OUTLIER -65.2 -130.26 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.53 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 1.5 t0 175.28 -174.06 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.232 0.924 . . . . 0.0 112.256 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.855 ' CD2' HG21 ' A' ' 85' ' ' VAL . 43.3 p90 -83.19 -57.07 3.43 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.095 -179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.456 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -78.27 -30.8 48.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.444 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.859 ' O ' HD23 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.63 -48.14 10.46 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.528 ' CB ' ' HB2' ' B' ' 17' ' ' PHE . 1.7 t80 -65.32 -52.86 51.21 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.32 178.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' B' ' 13' ' ' LEU . 6.1 mt -53.3 -38.93 63.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.964 0.411 . . . . 0.0 110.147 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -36.81 58.27 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.859 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -61.27 -57.35 12.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.891 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 1.027 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.1 -44.92 30.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 O-C-N 123.639 0.587 . . . . 0.0 110.76 178.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.487 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -52.66 -50.77 47.7 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.521 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -56.66 -31.17 60.26 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 120.197 -1.002 . . . . 0.0 111.505 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.833 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 16.8 mt -66.63 -44.73 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.65 -33.94 64.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.237 0.541 . . . . 0.0 110.787 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.849 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.95 9.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.793 -179.442 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.612 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -115.14 14.47 17.01 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.226 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.64 -40.5 0.05 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.443 -179.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.504 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.8 t-160 -93.44 178.0 5.85 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-O 120.94 0.4 . . . . 0.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -63.71 93.64 0.08 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.273 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.551 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 173.93 111.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.606 179.722 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.546 ' HB2' HG12 ' B' ' 85' ' ' VAL . 1.1 t80 68.67 -67.02 0.22 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.823 -179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p -61.67 -24.1 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.131 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.53 -23.35 25.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -93.91 19.09 9.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.766 ' HB3' ' HD3' ' B' ' 96' ' ' PRO . . . -102.44 -54.7 0.12 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.595 -179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.766 ' HD3' ' HB3' ' B' ' 95' ' ' ALA . 59.9 Cg_exo -53.94 -44.06 52.61 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.694 2.263 . . . . 0.0 112.874 -179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.482 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 97.3 Cg_endo -85.43 30.15 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.554 2.169 . . . . 0.0 112.936 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -158.59 31.25 0.23 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.797 0.332 . . . . 0.0 110.81 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.8 35.15 3.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.896 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.85 -46.33 0.08 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 62.6 t80 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.89 179.95 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.699 0.285 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.42 ' N ' ' CD ' ' A' ' 3' ' ' PRO . 5.2 mtm105 -88.16 -51.24 0.4 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.976 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 29.9 Cg_exo -66.28 -129.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.089 2.526 . . . . 0.0 111.799 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -132.21 145.18 51.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.338 0.589 . . . . 0.0 111.207 -179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.03 10.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.101 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.992 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -65.52 -41.59 92.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.07 179.075 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.13 -35.72 36.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.498 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.67 -27.13 40.84 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.75 178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.603 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.5 p -70.45 -41.37 72.93 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.296 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' A' ' 14' ' ' ILE . 2.9 mp -69.3 -54.95 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.731 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.994 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -51.84 -27.22 11.83 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 6.1 m -75.25 -55.83 5.32 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.84 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' B' ' 13' ' ' LEU . 3.9 mm? -61.13 -27.34 68.32 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' A' ' 10' ' ' ILE . 9.3 mt -71.8 -37.4 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 CA-C-O 121.505 0.669 . . . . 0.0 110.332 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.54 64.03 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.875 -177.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.838 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.4 m -53.8 -35.7 27.92 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 CA-C-O 121.48 0.657 . . . . 0.0 109.479 178.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.491 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -80.33 -59.74 2.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.582 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.942 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -69.91 -24.97 63.47 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -178.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -51.71 57.92 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.244 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.541 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.9 m-85 -80.19 -40.22 27.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.712 0.768 . . . . 0.0 109.41 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.942 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.85 -26.16 57.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.707 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -108.33 174.75 19.18 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.712 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.9 -40.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.86 0.362 . . . . 0.0 110.763 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -106.28 -32.16 8.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.935 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -166.25 -127.34 0.89 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.492 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -101.33 124.32 46.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.804 0.335 . . . . 0.0 110.887 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 t -114.77 160.89 18.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.5 p -108.98 -19.28 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.356 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.654 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 1.1 p -129.98 -176.87 4.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.753 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.657 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -137.81 -122.96 0.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.524 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.634 ' N ' HD22 ' A' ' 30' ' ' LEU . 18.5 t -179.82 127.9 0.09 Allowed 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HE2' HD11 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -49.77 -40.69 42.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.18 -179.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.63 ' HA ' HD13 ' A' ' 36' ' ' LEU . 5.0 t -61.86 -43.51 98.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.69 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.459 ' N ' HG23 ' A' ' 33' ' ' THR . 15.7 mt-10 -61.52 -35.75 78.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 178.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.89 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -74.2 -29.9 61.95 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 176.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -57.84 -59.36 5.35 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.873 178.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.0 p -63.55 -41.19 98.44 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.489 179.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.423 ' CD2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 t80 -60.02 -45.22 93.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.406 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.435 ' HE2' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -62.46 -31.28 71.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.788 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 18.7 m-80 -73.52 -19.74 60.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.08 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.39 -79.34 0.58 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.091 0.472 . . . . 0.0 111.862 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.423 ' HG3' ' CD2' ' A' ' 38' ' ' PHE . 2.7 mt-10 -52.07 -29.04 19.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.224 -178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.728 HD21 HD11 ' B' ' 10' ' ' ILE . 52.6 mt -130.41 50.14 2.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.099 0.476 . . . . 0.0 110.828 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -79.2 -28.45 42.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.779 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.04 -24.63 67.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.137 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.47 ' HD2' HD22 ' A' ' 43' ' ' LEU . 39.3 m-85 -102.06 27.2 6.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.962 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 65.0 p -150.35 -43.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.202 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -48.62 -79.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.377 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -106.63 78.46 1.27 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.004 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -116.88 139.69 50.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.949 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.3 -31.37 16.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.907 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.483 ' HB3' HG23 ' A' ' 55' ' ' VAL . 1.2 t0 -83.54 110.62 25.81 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.931 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo -85.24 19.85 1.33 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.858 2.372 . . . . 0.0 112.738 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -122.68 14.79 8.56 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.625 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 86' ' ' ALA . 39.0 t -84.24 -61.22 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.953 0.406 . . . . 0.0 111.046 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 59' ' ' MET . 7.7 tp -67.67 -51.16 53.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.96 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.84 -27.0 49.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.262 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -50.52 71.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.053 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.911 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.4 ptp -57.07 -53.52 57.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.277 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.872 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -58.73 -22.91 58.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.364 -179.534 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -78.56 -60.37 2.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.951 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.19 6.32 12.08 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 60' ' ' MET . 0.4 OUTLIER -73.58 -5.77 42.42 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.62 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.635 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.7 OUTLIER 64.31 -82.23 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.688 0.28 . . . . 0.0 110.593 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.863 HD23 ' HG ' ' A' ' 63' ' ' LEU . 0.3 OUTLIER 62.69 -76.08 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.311 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.415 ' N ' ' O ' ' A' ' 64' ' ' ASP . 14.4 m-20 64.39 19.71 11.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.072 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m 50.53 -175.29 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.126 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.91 24.64 6.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.847 -179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' A' ' 70' ' ' GLN . . . -156.87 -142.27 3.37 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.321 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.605 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.1 OUTLIER -152.81 -174.98 5.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.779 0.323 . . . . 0.0 110.985 -179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.661 HD22 HD21 ' A' ' 65' ' ' LEU . 0.3 OUTLIER -65.29 -131.38 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.932 179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.456 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 172.69 -168.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.879 0.763 . . . . 0.0 111.364 179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.885 ' CG ' HG11 ' B' ' 85' ' ' VAL . 39.8 p90 -80.84 -60.51 2.28 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.894 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.483 HE22 ' HB2' ' A' ' 78' ' ' ASN . 0.3 OUTLIER -80.1 -22.19 42.46 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.104 -0.638 . . . . 0.0 110.225 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.781 ' O ' HD13 ' A' ' 79' ' ' LEU . 2.1 tt0 -47.17 -32.66 4.55 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 178.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.531 ' CD1' HG23 ' A' ' 16' ' ' VAL . 2.3 t80 -80.51 -54.31 5.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.722 178.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' B' ' 77' ' ' LEU . 5.8 mt -53.75 -33.97 57.48 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.483 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.43 -40.71 49.88 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 177.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.89 HD23 ' CD2' ' A' ' 35' ' ' PHE . 1.7 mp -62.39 -57.64 10.55 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.03 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.891 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -75.21 -45.27 41.93 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.163 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.121 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.559 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.44 -48.87 53.87 Favored Glycine 0 C--N 1.334 0.437 0 N-CA-C 110.43 -1.068 . . . . 0.0 110.43 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.51 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.47 -41.44 48.84 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.255 -0.974 . . . . 0.0 111.318 178.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.911 HD21 ' HE2' ' A' ' 59' ' ' MET . 9.1 mt -56.72 -47.65 79.49 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 110.661 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.62 -32.61 63.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.184 0.516 . . . . 0.0 111.27 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.27 -17.57 9.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.607 -179.411 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.652 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -112.5 2.21 16.22 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.368 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.492 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -137.6 -41.48 0.55 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 -179.934 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' B' ' 14' ' ' ILE . 0.7 OUTLIER -82.09 -166.64 1.29 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.887 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.87 36.4 1.3 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.312 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.618 ' HB2' HG13 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -99.53 7.56 45.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.091 179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.779 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 177.92 -39.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.005 0.431 . . . . 0.0 110.386 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.421 HG12 ' N ' ' A' ' 93' ' ' LYS . 7.1 t -60.33 158.31 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.857 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.421 ' N ' HG12 ' A' ' 92' ' ' VAL . 0.0 OUTLIER 61.57 17.42 8.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.989 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 91' ' ' PHE . . . -117.36 -26.72 6.61 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.133 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.591 ' HB1' ' CB ' ' A' ' 98' ' ' GLN . . . -140.06 53.95 4.89 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.479 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.563 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 34.7 Cg_exo -59.34 -47.47 16.94 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.418 2.079 . . . . 0.0 112.713 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.464 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 97.7 Cg_endo -84.35 -23.49 2.85 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.633 2.222 . . . . 0.0 112.682 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.591 ' CB ' ' HB1' ' A' ' 95' ' ' ALA . 7.1 tm0? -50.05 149.8 2.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.301 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -121.84 102.37 8.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.879 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 -96.2 -34.85 11.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.91 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.927 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.745 0.307 . . . . 0.0 111.253 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.416 ' N ' ' CD ' ' B' ' 3' ' ' PRO . 5.2 mtm105 -88.16 -51.18 0.4 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.0 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.416 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 30.2 Cg_exo -66.38 -129.85 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.471 0 C-N-CA 122.994 2.463 . . . . 0.0 111.813 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -132.2 145.13 51.13 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.246 0.546 . . . . 0.0 111.242 -180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.87 -46.06 10.61 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.074 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.995 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -65.44 -41.62 93.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.192 0.52 . . . . 0.0 110.108 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.14 -35.71 37.12 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.539 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 -27.25 41.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.803 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.618 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.5 p -70.33 -41.42 73.24 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.322 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.06 HG22 HD11 ' B' ' 14' ' ' ILE . 2.9 mp -69.32 -54.99 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.707 -179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.1 OUTLIER -51.75 -27.29 11.59 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -178.336 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.559 ' O ' HG13 ' B' ' 16' ' ' VAL . 6.2 m -75.25 -55.92 5.23 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.934 -0.307 . . . . 0.0 111.764 -179.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.854 HD23 HD23 ' A' ' 13' ' ' LEU . 3.9 mm? -61.03 -27.29 68.22 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.06 HD11 HG22 ' B' ' 10' ' ' ILE . 9.3 mt -71.86 -37.42 61.63 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.793 0 CA-C-O 121.478 0.656 . . . . 0.0 110.336 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 -39.57 64.12 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.073 -1.421 . . . . 0.0 111.917 -177.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.827 HG22 ' O ' ' B' ' 13' ' ' LEU . 19.4 m -53.76 -35.7 27.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.487 0.661 . . . . 0.0 109.479 178.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.487 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -80.28 -59.78 2.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.617 -178.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.94 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.6 OUTLIER -69.92 -24.92 63.45 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -178.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -51.79 57.14 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.258 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.528 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.9 m-85 -80.2 -40.1 27.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.68 0.752 . . . . 0.0 109.413 177.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.94 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -57.01 -26.09 59.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.675 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -108.26 174.83 19.31 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.718 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.99 -40.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.782 0.325 . . . . 0.0 110.766 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -106.29 -32.22 8.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.871 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -166.16 -127.35 0.89 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.501 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 65.3 m-70 -101.34 124.26 46.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.776 0.322 . . . . 0.0 110.946 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.8 t -114.74 160.86 18.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 13.8 p -108.96 -19.2 6.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.443 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.664 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 1.1 p -130.05 -176.86 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.711 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.66 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -137.8 -122.92 0.13 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.539 -179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.635 ' N ' HD22 ' B' ' 30' ' ' LEU . 18.8 t -179.88 127.84 0.08 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.495 ' HE2' HD11 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -49.58 -40.68 39.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.239 -179.149 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.626 ' HA ' HD13 ' B' ' 36' ' ' LEU . 5.0 t -61.99 -43.44 98.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.721 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.464 ' N ' HG23 ' B' ' 33' ' ' THR . 15.7 mt-10 -61.5 -35.65 78.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.896 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -74.32 -29.85 61.79 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 176.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.626 HD13 ' HA ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -57.81 -59.39 5.3 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.874 178.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.9 p -63.6 -41.16 98.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.411 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' B' ' 42' ' ' GLU . 9.0 t80 -60.08 -45.19 93.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.429 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.422 ' HE2' HD13 ' B' ' 43' ' ' LEU . 0.0 OUTLIER -62.39 -31.39 72.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.824 179.883 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 18.9 m-80 -73.4 -19.72 60.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.242 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -113.45 -79.46 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.102 0.477 . . . . 0.0 111.777 -179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.425 ' HG3' ' CD2' ' B' ' 38' ' ' PHE . 2.7 mt-10 -52.02 -29.04 19.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.224 -178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.758 HD21 HD11 ' A' ' 10' ' ' ILE . 53.6 mt -130.33 50.09 2.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.039 0.447 . . . . 0.0 110.811 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -79.22 -28.41 42.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.01 -24.71 67.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.072 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.495 ' HD2' HD22 ' B' ' 43' ' ' LEU . 39.0 m-85 -102.08 27.26 6.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.96 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 65.4 p -150.36 -43.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.177 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -48.67 -79.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.38 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -106.67 78.42 1.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.004 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -116.86 139.7 50.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.962 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.34 -31.35 16.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.821 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.479 ' HB3' HG23 ' B' ' 55' ' ' VAL . 1.2 t0 -83.55 110.67 26.18 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.94 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 52' ' ' ASP . 3.9 Cg_endo -85.31 19.88 1.33 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.866 2.377 . . . . 0.0 112.611 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -122.67 14.74 8.57 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.653 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 86' ' ' ALA . 39.0 t -84.17 -61.22 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.019 0.438 . . . . 0.0 111.094 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.453 ' O ' ' HG2' ' B' ' 59' ' ' MET . 7.7 tp -67.74 -51.09 53.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.997 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -55.83 -26.96 49.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.32 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.93 -50.42 72.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.008 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.933 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.4 ptp -57.13 -53.48 57.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.293 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.873 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -58.76 -22.91 59.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.399 -179.566 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -78.59 -60.39 2.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.931 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.16 6.35 11.96 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.873 HD22 ' O ' ' B' ' 60' ' ' MET . 0.4 OUTLIER -73.63 -5.73 42.24 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.603 -179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.633 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.7 OUTLIER 64.21 -82.21 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.654 0.264 . . . . 0.0 110.535 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.868 HD23 ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER 62.78 -76.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.216 179.562 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' B' ' 64' ' ' ASP . 14.3 m-20 64.42 19.68 11.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.024 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.1 m 50.58 -175.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.81 0.338 . . . . 0.0 111.107 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 54.93 24.61 6.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.768 -179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . -156.83 -142.31 3.38 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.313 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.605 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.1 OUTLIER -152.69 -174.9 5.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.848 0.356 . . . . 0.0 110.913 -179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.682 HD22 HD21 ' B' ' 65' ' ' LEU . 0.3 OUTLIER -65.35 -131.4 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.931 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.446 ' O ' ' CE1' ' B' ' 17' ' ' PHE . 0.2 OUTLIER 172.68 -168.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 118.939 0.791 . . . . 0.0 111.392 179.984 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CG ' HG11 ' A' ' 85' ' ' VAL . 39.9 p90 -80.92 -60.6 2.24 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.761 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -80.03 -22.25 42.6 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.171 -0.611 . . . . 0.0 110.21 179.46 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.1 tt0 -47.19 -32.66 4.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 178.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD1' HG23 ' B' ' 16' ' ' VAL . 2.2 t80 -80.48 -54.28 5.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.765 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.732 HD22 HD22 ' A' ' 77' ' ' LEU . 5.8 mt -53.79 -33.88 57.37 Favored 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.468 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -40.73 49.8 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.793 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.896 HD23 ' CD2' ' B' ' 35' ' ' PHE . 1.7 mp -62.24 -57.67 10.59 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.07 179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.91 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -75.24 -45.32 41.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.073 179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.567 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.5 -48.86 54.28 Favored Glycine 0 C--N 1.333 0.4 0 N-CA-C 110.419 -1.072 . . . . 0.0 110.419 179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.508 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.43 -41.36 48.38 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.142 -1.028 . . . . 0.0 111.359 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.933 HD21 ' HE2' ' B' ' 59' ' ' MET . 9.2 mt -56.93 -47.55 80.37 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 120.676 0.274 . . . . 0.0 110.623 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.47 -32.81 63.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.199 0.523 . . . . 0.0 111.254 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.885 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.24 -17.51 9.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.592 -179.332 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.638 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -112.48 2.17 16.22 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.418 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -137.59 -41.49 0.55 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.886 -179.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.684 ' ND1' HD13 ' A' ' 14' ' ' ILE . 0.7 OUTLIER -82.06 -166.65 1.29 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.815 0.34 . . . . 0.0 110.919 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.76 36.35 1.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.346 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.619 ' HB2' HG13 ' B' ' 85' ' ' VAL . 0.0 OUTLIER -99.56 7.53 45.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.051 179.744 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.793 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 177.88 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.978 0.418 . . . . 0.0 110.447 179.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.419 HG12 ' N ' ' B' ' 93' ' ' LYS . 7.4 t -60.38 158.35 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.799 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.419 ' N ' HG12 ' B' ' 92' ' ' VAL . 0.0 OUTLIER 61.55 17.41 8.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.002 -179.77 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' B' ' 91' ' ' PHE . . . -117.39 -26.68 6.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.128 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.598 ' HB1' ' CB ' ' B' ' 98' ' ' GLN . . . -140.13 53.96 4.84 Favored Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.497 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.569 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 34.9 Cg_exo -59.27 -47.51 16.97 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.418 2.079 . . . . 0.0 112.701 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.465 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 96.6 Cg_endo -84.43 -23.32 2.87 Favored 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 122.517 2.145 . . . . 0.0 112.733 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.598 ' CB ' ' HB1' ' B' ' 95' ' ' ALA . 7.1 tm0? -50.06 149.72 2.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.318 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -121.71 102.32 8.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.889 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 2.0 ptt-85 -96.17 -34.91 11.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.9 179.967 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.827 0.346 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -99.68 167.82 10.51 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.893 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -62.45 -126.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.926 2.418 . . . . 0.0 111.835 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -177.44 149.11 0.62 Allowed 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.544 0.688 . . . . 0.0 111.152 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.36 -48.98 13.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.417 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.952 ' O ' HD12 ' A' ' 10' ' ' ILE . 2.3 m -64.34 -37.1 86.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.53 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.75 -38.25 54.63 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.727 -179.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.87 -26.77 43.99 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.092 179.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.523 ' HB3' HD22 ' B' ' 13' ' ' LEU . 63.9 m -69.23 -52.99 22.21 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.139 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -53.25 -56.15 9.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.541 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.44 -27.31 15.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.601 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -68.52 -55.9 10.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.96 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -68.68 -27.69 66.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -178.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.139 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -68.1 -36.34 75.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 O-C-N 121.666 -0.646 . . . . 0.0 110.508 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.6 -32.65 41.89 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.482 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.2 m -51.73 -37.14 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.473 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.9 t80 -78.37 -58.54 3.2 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.319 179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.788 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.5 mm-40 -49.13 -32.92 10.85 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.23 -51.96 67.59 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.876 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.1 m-85 -81.2 -47.69 13.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.778 0.799 . . . . 0.0 109.963 178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.438 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -61.31 -17.03 51.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.28 -1.327 . . . . 0.0 111.887 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -75.32 143.15 30.22 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.491 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -165.54 -43.91 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.828 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -157.0 169.33 25.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.913 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.74 65.97 3.11 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.478 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -176.57 -39.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.773 0.32 . . . . 0.0 110.941 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -56.41 143.0 36.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.929 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 28' ' ' VAL . 14.3 p -145.99 24.64 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.38 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 3.3 p -143.38 150.84 39.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.144 0.497 . . . . 0.0 111.455 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -107.69 -152.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.961 179.264 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.451 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -148.52 147.62 29.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.207 0.527 . . . . 0.0 111.089 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.599 ' HG2' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -53.4 -44.76 68.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.755 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.056 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -74.62 -36.4 62.93 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.33 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.426 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -55.06 -30.63 60.02 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.514 ' CE2' ' HB3' ' A' ' 79' ' ' LEU . 2.3 t80 -81.21 -47.55 13.26 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.272 177.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 1.056 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.6 OUTLIER -63.46 -28.08 69.72 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 120.783 0.325 . . . . 0.0 110.39 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.57 -28.38 33.86 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 20' ' ' TYR . 3.4 t80 -59.06 -54.79 43.09 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.983 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.568 ' HE2' ' HB3' ' A' ' 43' ' ' LEU . 2.8 mtp -48.8 -30.11 5.34 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.521 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -73.59 -19.47 60.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.186 -179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 38' ' ' PHE . 0.7 OUTLIER -105.11 -50.8 3.16 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.309 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.569 ' O ' HG21 ' B' ' 4' ' ' THR . 1.1 mm-40 -128.31 -12.55 5.07 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -177.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.945 HD21 HD11 ' B' ' 10' ' ' ILE . 6.4 mt -117.48 46.71 1.66 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.353 0.597 . . . . 0.0 110.296 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.11 -30.54 27.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.993 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.43 -26.02 28.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.823 179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -97.23 22.72 8.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.866 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.56 HG21 ' HB3' ' A' ' 39' ' ' MET . 26.2 p -147.4 -40.1 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.208 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -44.0 150.43 0.27 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.085 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.68 -54.69 0.67 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.95 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.28 64.57 0.1 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.1 0.476 . . . . 0.0 111.085 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.35 10.34 31.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.941 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.642 ' O ' HG13 ' A' ' 55' ' ' VAL . 1.3 m-20 -138.57 68.26 45.06 Favored Pre-proline 0 C--N 1.332 -0.168 0 CA-C-O 120.93 0.395 . . . . 0.0 110.84 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -60.88 91.13 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.53 2.154 . . . . 0.0 112.023 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.58 -11.7 0.63 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.403 -0.903 . . . . 0.0 113.48 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.686 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m -77.44 -50.38 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 117.263 0.531 . . . . 0.0 110.53 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.48 ' N ' HG22 ' A' ' 55' ' ' VAL . 8.7 tp -68.99 -51.48 38.96 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.002 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.16 -28.72 69.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.212 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.61 73.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.821 0.344 . . . . 0.0 110.849 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 1.113 ' HE3' HD21 ' A' ' 83' ' ' LEU . 1.8 ptp -67.27 -53.44 29.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.138 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.585 ' O ' HD21 ' A' ' 65' ' ' LEU . 10.0 mmt -63.66 -22.83 67.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.31 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.37 -55.57 5.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.43 -3.62 50.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.235 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.011 HD22 HD23 ' A' ' 65' ' ' LEU . 3.2 tt -68.01 -26.86 66.11 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.945 0.402 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 64.08 49.91 2.59 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.053 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 1.011 HD23 HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -74.84 -79.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.037 -179.767 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 61.13 32.06 19.65 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.866 0.365 . . . . 0.0 110.588 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.6 m 67.36 141.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.936 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 63.58 167.13 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.7 -40.62 2.6 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.436 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.542 HE21 ' HA ' ' A' ' 70' ' ' GLN . 2.2 mm-40 62.96 156.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.389 0.138 . . . . 0.0 111.092 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.661 HD11 HD22 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -54.2 -130.62 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.571 -179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.596 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 3.8 p30 162.4 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.841 ' CG ' HG11 ' B' ' 85' ' ' VAL . 41.6 p90 -83.39 -58.62 2.75 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.54 ' O ' ' N ' ' A' ' 78' ' ' ASN . 42.0 tp60 -80.33 -34.54 36.56 Favored 'General case' 0 C--O 1.223 -0.338 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.619 ' HB3' ' HG ' ' A' ' 71' ' ' LEU . 2.2 tt0 -44.49 -39.54 4.9 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.285 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.546 ' CD2' HD12 ' A' ' 30' ' ' LEU . 3.2 t80 -71.74 -52.86 15.58 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.749 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -55.62 -33.45 64.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -73.03 -40.3 65.25 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.852 HD11 ' HB2' ' A' ' 63' ' ' LEU . 1.8 mp -62.51 -57.13 12.26 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.543 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.074 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -70.45 -42.74 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.174 0 CA-C-O 120.828 0.347 . . . . 0.0 110.507 178.567 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.67 -50.58 48.57 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.413 -0.899 . . . . 0.0 110.895 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.579 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.74 -41.0 49.89 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.352 -0.927 . . . . 0.0 111.721 178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 1.113 HD21 ' HE3' ' A' ' 59' ' ' MET . 4.0 mt -60.17 -46.79 88.51 Favored 'General case' 0 C--N 1.332 -0.175 0 O-C-N 122.634 -0.333 . . . . 0.0 110.787 179.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.6 -29.13 58.58 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.093 0.473 . . . . 0.0 111.296 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.834 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.61 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.114 -178.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -117.66 8.46 12.82 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.963 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.82 -37.78 0.4 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.663 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.602 ' CD2' HD13 ' B' ' 14' ' ' ILE . 1.6 t60 -103.49 166.68 10.28 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.883 0.373 . . . . 0.0 111.06 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -59.75 115.7 3.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.168 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.64 -68.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.681 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.741 ' HB2' HG12 ' A' ' 85' ' ' VAL . 4.5 t80 -114.67 -32.56 5.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.749 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.37 -26.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.472 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 15.9 ttpp -92.44 16.57 11.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.127 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.5 22.35 3.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.157 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.954 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -124.82 72.73 62.87 Favored Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.439 ' N ' ' CD ' ' A' ' 97' ' ' PRO . 39.2 Cg_exo -58.92 -47.35 18.43 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.824 2.349 . . . . 0.0 112.819 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 84.3 Cg_endo -81.85 -28.51 2.08 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.412 2.075 . . . . 0.0 112.374 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.954 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 3.1 tt0 -57.4 90.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.973 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.93 -175.19 3.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.91 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.52 -64.41 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.983 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 7.8 t80 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.89 -179.986 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.839 0.352 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 -99.64 167.87 10.44 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.9 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -62.53 -126.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.986 2.457 . . . . 0.0 111.825 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.681 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -177.43 149.0 0.62 Allowed 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.51 0.671 . . . . 0.0 111.229 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -45.3 -49.08 12.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.323 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.961 ' O ' HD12 ' B' ' 10' ' ' ILE . 2.4 m -64.32 -37.04 86.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.51 179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.681 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -38.19 54.61 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.768 -179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttp180 -78.91 -26.82 43.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.061 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.529 ' HB3' HD22 ' A' ' 13' ' ' LEU . 63.9 m -69.21 -52.93 22.97 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.244 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.11 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -53.19 -56.18 9.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.639 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.948 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.28 -27.52 15.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -178.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.614 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -68.5 -55.86 10.32 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.697 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.958 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -68.67 -27.76 66.27 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.11 HD11 HG22 ' B' ' 10' ' ' ILE . 7.6 mt -68.08 -36.4 75.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 O-C-N 121.724 -0.61 . . . . 0.0 110.446 179.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.58 -32.56 42.0 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.545 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.958 HG22 ' O ' ' B' ' 13' ' ' LEU . 24.9 m -51.77 -37.12 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.467 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.8 t80 -78.39 -58.62 3.16 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.3 179.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.5 mm-40 -49.06 -32.94 10.48 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.16 -51.93 67.66 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.959 -179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.667 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.1 m-85 -81.17 -47.74 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.782 0.801 . . . . 0.0 109.952 178.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.422 ' HB2' ' CE1' ' B' ' 17' ' ' PHE . . . -61.43 -16.92 51.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.926 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.421 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -75.27 143.1 30.21 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.603 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tttm -165.51 -43.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.835 0.35 . . . . 0.0 110.828 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -156.99 169.36 25.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.874 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.72 65.93 3.11 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.57 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -176.55 -39.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.815 0.341 . . . . 0.0 110.956 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.4 p -56.33 142.91 36.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.989 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.638 HG22 ' O ' ' B' ' 28' ' ' VAL . 14.2 p -145.9 24.66 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.396 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 3.3 p -143.39 150.83 39.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.211 0.529 . . . . 0.0 111.508 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.667 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -107.71 -152.33 0.48 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.91 179.361 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.45 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.9 OUTLIER -148.49 147.51 29.19 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.128 0.489 . . . . 0.0 111.115 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.583 ' HG2' HD22 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -53.26 -44.81 68.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.751 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 1.004 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -74.61 -36.41 62.95 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.295 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.421 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -55.16 -30.59 60.15 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.481 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.521 ' CE2' ' HB3' ' B' ' 79' ' ' LEU . 2.3 t80 -81.28 -47.52 13.23 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.246 177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 1.004 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.6 OUTLIER -63.42 -28.03 69.7 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 120.872 0.367 . . . . 0.0 110.509 -179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 2.3 m -81.55 -28.42 33.91 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.222 0.534 . . . . 0.0 109.641 177.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.498 ' CD2' ' CD1' ' B' ' 20' ' ' TYR . 3.4 t80 -58.95 -54.79 43.17 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.01 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.571 ' HA ' ' CB ' ' B' ' 43' ' ' LEU . 2.7 mtp -48.89 -30.17 5.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -73.55 -19.51 60.88 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' B' ' 38' ' ' PHE . 0.7 OUTLIER -105.08 -50.74 3.17 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -178.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.581 ' O ' HG21 ' A' ' 4' ' ' THR . 1.1 mm-40 -128.42 -12.5 5.01 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -177.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.991 HD21 HD11 ' A' ' 10' ' ' ILE . 6.4 mt -117.63 46.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.294 0.568 . . . . 0.0 110.218 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.19 -30.53 27.7 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.989 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.39 -26.03 27.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.898 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -97.28 22.87 8.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.852 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.548 HG21 ' HB3' ' B' ' 39' ' ' MET . 26.6 p -147.55 -40.02 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.178 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 44.3 mttm -44.05 150.41 0.28 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.002 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 71.79 -54.8 0.67 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.902 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 73.33 64.67 0.1 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.102 0.477 . . . . 0.0 111.03 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.37 10.22 31.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.962 179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.64 ' O ' HG13 ' B' ' 55' ' ' VAL . 1.3 m-20 -138.52 68.22 45.39 Favored Pre-proline 0 C--N 1.332 -0.155 0 CA-C-O 120.942 0.401 . . . . 0.0 110.881 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -60.94 91.16 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.536 2.157 . . . . 0.0 111.976 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.49 -11.59 0.64 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.527 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.703 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m -77.5 -50.4 20.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 117.281 0.541 . . . . 0.0 110.489 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.478 ' N ' HG22 ' B' ' 55' ' ' VAL . 8.7 tp -69.05 -51.47 38.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.96 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -61.14 -28.69 69.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.274 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -35.57 73.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 1.072 ' HE3' HD21 ' B' ' 83' ' ' LEU . 1.8 ptp -67.23 -53.41 30.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.178 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.595 ' O ' HD21 ' B' ' 65' ' ' LEU . 10.0 mmt -63.7 -22.92 67.15 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.247 -179.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -55.7 5.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -80.39 -3.58 50.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 0.0 112.237 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 1.049 HD22 HD23 ' B' ' 65' ' ' LEU . 3.2 tt -67.97 -26.87 66.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.028 0.442 . . . . 0.0 111.026 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 64.03 50.01 2.6 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.006 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 1.049 HD23 HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -74.83 -79.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.99 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 61.13 32.01 19.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.912 0.387 . . . . 0.0 110.677 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 14.6 m 67.35 141.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.941 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 63.56 167.1 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.73 -40.6 2.6 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.485 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.546 ' HA ' HE21 ' B' ' 70' ' ' GLN . 2.2 mm-40 63.07 156.01 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.391 0.139 . . . . 0.0 111.043 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.664 HD11 HD22 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -54.3 -130.64 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.593 -179.685 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.598 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 3.7 p30 162.53 -148.09 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.834 ' CG ' HG11 ' A' ' 85' ' ' VAL . 41.7 p90 -83.38 -58.57 2.77 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 -179.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.586 ' O ' ' N ' ' B' ' 78' ' ' ASN . 42.1 tp60 -80.31 -34.59 36.65 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -178.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.615 ' O ' HD13 ' B' ' 79' ' ' LEU . 2.2 tt0 -44.63 -39.39 4.99 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.296 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.535 ' CD2' HD12 ' B' ' 30' ' ' LEU . 3.2 t80 -71.72 -52.9 15.4 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.777 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.4 mt -55.56 -33.51 63.93 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.586 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -72.96 -40.35 65.41 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.86 HD11 ' HB2' ' B' ' 63' ' ' LEU . 1.8 mp -62.47 -57.22 12.0 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.472 179.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.989 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -70.43 -42.75 78.46 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.769 0.319 . . . . 0.0 110.497 178.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.67 -50.64 48.3 Favored Glycine 0 N--CA 1.451 -0.349 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.572 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.79 -40.95 50.17 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.37 -0.919 . . . . 0.0 111.725 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 1.072 HD21 ' HE3' ' B' ' 59' ' ' MET . 4.0 mt -60.09 -46.87 88.14 Favored 'General case' 0 C--N 1.332 -0.171 0 O-C-N 122.624 -0.339 . . . . 0.0 110.813 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.51 -29.1 58.25 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-O 121.089 0.471 . . . . 0.0 111.348 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.841 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.62 9.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.546 -0.752 . . . . 0.0 112.04 -178.748 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -117.66 8.45 12.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.978 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -141.81 -37.81 0.4 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.655 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.61 ' CD2' HD13 ' A' ' 14' ' ' ILE . 1.6 t60 -103.5 166.61 10.32 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.922 0.391 . . . . 0.0 111.052 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.64 115.71 3.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.152 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.9 t -178.69 -68.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.703 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.78 ' HB2' HG12 ' B' ' 85' ' ' VAL . 4.5 t80 -114.58 -32.49 5.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.77 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.45 -26.15 5.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.505 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -92.34 16.5 11.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.143 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -135.48 22.32 3.41 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.157 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.903 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -124.81 72.69 62.66 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.148 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.438 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 40.2 Cg_exo -58.99 -47.28 18.52 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.695 2.263 . . . . 0.0 112.864 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 84.7 Cg_endo -81.79 -28.5 2.11 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.419 2.079 . . . . 0.0 112.387 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.903 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 3.1 tt0 -57.42 90.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.02 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -130.84 -175.07 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.865 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.63 -64.49 1.04 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 7.9 t80 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.897 -179.993 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.772 0.32 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.13 76.23 73.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.826 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -63.7 -127.11 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 123.163 2.575 . . . . 0.0 112.167 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.596 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -145.69 152.09 39.07 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.359 0.6 . . . . 0.0 111.106 -179.783 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -44.84 -49.31 10.91 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.621 -179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.868 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.3 OUTLIER -62.53 -39.11 92.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.122 0.487 . . . . 0.0 109.894 178.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.596 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.63 -30.25 20.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.293 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -27.91 41.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.777 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 5.5 p -75.3 -41.79 56.16 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.261 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.026 HG22 HD11 ' A' ' 14' ' ' ILE . 1.9 mp -68.26 -53.81 26.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.869 0.366 . . . . 0.0 111.301 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.897 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.5 OUTLIER -51.88 -27.29 12.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.101 -178.651 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' A' ' 16' ' ' VAL . 9.1 m -73.65 -56.05 5.5 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.916 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.6 mm? -63.43 -28.76 70.19 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.026 HD11 HG22 ' A' ' 10' ' ' ILE . 14.4 mt -68.97 -38.53 78.65 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.881 0 CA-C-O 121.593 0.711 . . . . 0.0 110.894 179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.66 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -78.46 -31.38 47.89 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 114.095 -1.411 . . . . 0.0 112.786 -175.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.916 HG22 ' O ' ' A' ' 13' ' ' LEU . 24.9 m -54.34 -40.77 49.76 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.868 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.624 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -81.71 -55.48 4.61 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -178.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.966 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -62.9 -24.76 67.99 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.733 -177.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.32 -51.38 62.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 9.8 m-85 -81.38 -29.01 34.13 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.815 176.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.966 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -85.88 20.25 2.28 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.121 -178.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.17 -158.74 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.495 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp 63.73 36.26 10.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.859 0.361 . . . . 0.0 110.917 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.35 166.93 7.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 120.66 -30.6 5.49 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.524 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.9 m170 -108.09 -30.8 8.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.852 0.358 . . . . 0.0 110.948 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.54 144.73 0.89 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.998 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.624 ' O ' HG13 ' A' ' 28' ' ' VAL . 7.1 p -91.17 81.29 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.886 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 9.2 p -154.25 160.99 42.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.196 0.522 . . . . 0.0 111.158 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.782 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -114.8 -116.73 0.32 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.009 179.423 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' A' ' 30' ' ' LEU . 23.1 t 179.98 130.16 0.09 Allowed 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.41 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 8.5 ttpt -49.73 -36.34 25.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.919 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.762 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -73.99 -45.25 51.09 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.803 179.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 31' ' ' SER . 4.2 mt-10 -55.92 -29.05 59.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.972 0.415 . . . . 0.0 110.276 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.23 -26.96 63.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.913 178.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.762 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.28 -58.87 5.92 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 121.663 0.744 . . . . 0.0 110.852 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.605 ' O ' HG22 ' A' ' 41' ' ' THR . 6.3 m -55.52 -44.95 77.15 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.815 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.463 ' CZ ' ' HB ' ' A' ' 16' ' ' VAL . 50.8 t80 -57.86 -27.21 63.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.044 0.45 . . . . 0.0 110.449 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.729 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -74.15 -64.61 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.69 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.624 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 66.7 m-80 -56.61 -19.44 16.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.032 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 1.048 HG23 ' HG2' ' A' ' 42' ' ' GLU . 12.2 t -98.52 -26.48 14.41 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 1.048 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.2 OUTLIER -129.9 -41.15 1.32 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.546 0.572 . . . . 0.0 112.546 -177.634 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' A' ' 39' ' ' MET . 14.0 mt -115.31 48.03 1.23 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.267 0.556 . . . . 0.0 110.046 179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.624 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -84.5 -35.68 22.75 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.327 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.4 -22.72 8.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.878 0.371 . . . . 0.0 110.925 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 87' ' ' CYS . 2.3 m-85 -88.98 -29.06 19.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.798 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.729 HG21 ' HG2' ' A' ' 39' ' ' MET . 2.1 t -131.99 47.22 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.849 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 44' ' ' ALA . 3.4 ptmt -93.77 -49.72 5.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.245 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -114.79 22.34 13.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 50.38 26.52 2.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.235 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.94 -34.49 68.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.01 0.433 . . . . 0.0 110.568 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.422 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . 2.5 m-20 -125.89 81.37 65.99 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.385 179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.63 -10.77 29.49 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.504 2.136 . . . . 0.0 112.537 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -81.59 -24.26 56.58 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.704 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.687 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 2.0 m -84.49 -53.66 10.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.987 0.422 . . . . 0.0 110.798 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.706 HD13 ' N ' ' A' ' 57' ' ' ASP . 0.5 OUTLIER -59.72 -51.46 69.69 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.703 -179.477 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.706 ' N ' HD13 ' A' ' 56' ' ' LEU . 35.9 t70 -67.81 -26.01 65.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.666 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.02 -33.61 69.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.862 0.363 . . . . 0.0 110.567 -179.895 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.868 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 0.3 OUTLIER -75.11 -54.3 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.096 0.474 . . . . 0.0 110.648 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.709 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 1.9 mtm -61.66 -40.18 94.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.774 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.13 -54.36 46.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.45 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.635 ' O ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -80.45 2.19 26.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.492 179.755 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.881 ' O ' HD13 ' A' ' 63' ' ' LEU . 1.9 tm? -46.04 -29.92 1.66 Allowed 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.781 0.324 . . . . 0.0 111.298 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -67.05 74.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.959 0.409 . . . . 0.0 110.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.847 HD21 ' ND2' ' A' ' 78' ' ' ASN . 3.6 mm? -91.09 71.02 6.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.915 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 65.69 -76.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.906 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -56.66 131.53 49.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.949 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.3 126.21 55.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.863 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 123.86 -40.15 2.02 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.505 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.428 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 2.2 mm-40 -133.92 169.4 17.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.75 0.309 . . . . 0.0 111.052 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.933 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.8 -133.53 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 179.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.725 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 20.7 t70 160.37 165.59 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 118.895 0.77 . . . . 0.0 111.121 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.632 ' CG ' HG11 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -46.46 -56.45 5.92 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.265 -179.527 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.57 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 23.9 tp60 -79.01 -33.25 45.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.521 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.933 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -44.79 -31.98 1.39 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.8 0.333 . . . . 0.0 110.25 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.632 ' HD1' HD12 ' A' ' 71' ' ' LEU . 1.5 m-85 -80.51 -54.76 5.39 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.708 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -61.69 -33.71 74.48 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.688 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.847 ' ND2' HD21 ' A' ' 65' ' ' LEU . 0.1 OUTLIER -71.87 -36.62 70.15 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 1.3 mp -65.74 -57.75 7.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.764 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.978 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.65 -41.99 48.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.844 0.354 . . . . 0.0 110.493 179.197 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -52.75 -49.99 51.52 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.77 -37.09 42.4 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 111.614 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.856 HD21 ' HE2' ' A' ' 59' ' ' MET . 5.4 mt -62.57 -47.49 83.62 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.807 0.337 . . . . 0.0 110.36 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.544 ' HB2' ' CG2' ' B' ' 10' ' ' ILE . . . -55.61 -30.8 61.53 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.361 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.627 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.19 -17.34 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.787 -178.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.687 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -115.44 7.69 15.08 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.622 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.442 ' HB3' ' CE2' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -145.8 -42.79 0.21 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.974 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.436 ' CD2' HG21 ' B' ' 10' ' ' ILE . 12.7 m-70 -85.83 176.44 8.1 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.879 0.371 . . . . 0.0 110.952 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.51 2.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.879 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.494 ' O ' HG21 ' B' ' 28' ' ' VAL . 0.1 OUTLIER -170.54 -56.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.823 -179.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.427 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -125.33 -44.49 1.87 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.914 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.7 p -73.91 -24.32 19.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.295 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.18 -18.66 14.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.225 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.83 17.35 10.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.482 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.54 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -178.4 62.15 0.15 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.039 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.453 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 46.3 Cg_exo -57.79 -46.79 24.28 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.557 2.171 . . . . 0.0 112.58 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 84.7 Cg_endo -82.8 -2.64 10.97 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.45 2.1 . . . . 0.0 112.531 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.54 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.5 OUTLIER -106.32 89.29 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.863 0.363 . . . . 0.0 110.891 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.17 99.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -148.98 152.91 37.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.933 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 16.3 t80 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.87 179.921 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.816 0.341 . . . . 0.0 111.289 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.12 76.17 73.67 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.774 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -63.68 -127.16 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.169 2.579 . . . . 0.0 112.127 -179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.592 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.1 OUTLIER -145.69 152.13 39.12 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.404 0.621 . . . . 0.0 111.018 -179.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -44.9 -49.26 11.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.629 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.876 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.4 OUTLIER -62.62 -39.01 92.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.095 0.474 . . . . 0.0 109.889 179.027 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.592 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.74 -30.26 21.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.282 179.633 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.54 -27.8 41.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.8 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB2' HD22 ' A' ' 13' ' ' LEU . 5.6 p -75.3 -41.84 56.05 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.26 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.012 HG22 HD11 ' B' ' 14' ' ' ILE . 1.9 mp -68.24 -53.76 26.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.4 . . . . 0.0 111.354 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.914 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.5 OUTLIER -51.91 -27.27 12.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.075 -178.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.629 ' O ' HG13 ' B' ' 16' ' ' VAL . 8.9 m -73.71 -56.04 5.5 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.902 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.6 mm? -63.48 -28.67 70.12 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -179.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.012 HD11 HG22 ' B' ' 10' ' ' ILE . 14.5 mt -69.04 -38.38 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.884 0 CA-C-O 121.508 0.671 . . . . 0.0 110.881 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . 0.668 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -78.59 -31.34 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.113 -1.403 . . . . 0.0 112.744 -175.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.902 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.0 m -54.38 -40.77 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -81.72 -55.41 4.65 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -178.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.939 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -62.86 -24.82 67.99 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.69 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.33 -51.37 62.63 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.503 ' HB3' HD21 ' B' ' 30' ' ' LEU . 9.7 m-85 -81.38 -28.97 34.17 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.835 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.939 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -85.89 20.29 2.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.116 -178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.19 -158.63 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.542 -0.837 . . . . 0.0 112.55 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mttp 63.66 36.32 10.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.824 0.345 . . . . 0.0 110.922 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.53 167.1 7.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.847 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 120.59 -30.59 5.51 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.456 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -108.08 -30.8 8.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.845 0.355 . . . . 0.0 110.97 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.51 144.74 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.985 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.629 ' O ' HG13 ' B' ' 28' ' ' VAL . 7.1 p -91.14 81.25 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.941 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 9.3 p -154.25 160.96 42.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.261 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.76 ' HB2' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -114.84 -116.75 0.32 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.997 179.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.499 ' N ' HD22 ' B' ' 30' ' ' LEU . 23.1 t -179.99 130.24 0.09 Allowed 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.421 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 8.5 ttpt -49.83 -36.27 26.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.891 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.764 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.08 -45.26 50.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.481 ' HB2' ' HB3' ' B' ' 31' ' ' SER . 4.2 mt-10 -55.9 -28.99 59.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.94 0.4 . . . . 0.0 110.352 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -71.19 -27.04 63.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.881 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.764 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.27 -58.92 5.73 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.616 0.722 . . . . 0.0 110.825 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.607 ' O ' HG22 ' B' ' 41' ' ' THR . 6.2 m -55.49 -44.86 76.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.878 -178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.467 ' HA ' HG22 ' B' ' 41' ' ' THR . 50.6 t80 -58.01 -27.13 63.25 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.464 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.731 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -74.19 -64.48 1.01 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.762 179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.625 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 66.8 m-80 -56.57 -19.66 16.99 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.983 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 1.049 HG23 ' HG2' ' B' ' 42' ' ' GLU . 12.1 t -98.4 -26.36 14.5 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 1.049 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.2 OUTLIER -129.92 -41.19 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.619 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.478 HD12 ' CE ' ' B' ' 39' ' ' MET . 13.9 mt -115.35 48.07 1.23 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.224 0.535 . . . . 0.0 109.955 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -84.58 -35.59 22.67 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.389 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.51 -22.67 8.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.949 0.404 . . . . 0.0 111.008 179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' B' ' 87' ' ' CYS . 2.4 m-85 -89.01 -29.0 19.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.782 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.731 HG21 ' HG2' ' B' ' 39' ' ' MET . 2.1 t -132.01 47.23 2.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.862 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' B' ' 44' ' ' ALA . 3.4 ptmt -93.81 -49.69 5.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.26 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.85 22.36 13.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.011 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 50.33 26.58 2.32 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.214 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.97 -34.57 68.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 0.0 110.563 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.42 ' HB3' ' CG1' ' B' ' 55' ' ' VAL . 2.5 m-20 -125.79 81.39 65.61 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.423 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.62 -10.78 29.54 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.573 2.182 . . . . 0.0 112.573 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -81.59 -24.3 56.5 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.731 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 2.0 m -84.54 -53.51 10.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.045 0.45 . . . . 0.0 110.858 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.695 HD13 ' N ' ' B' ' 57' ' ' ASP . 0.5 OUTLIER -59.74 -51.38 70.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.755 -179.535 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.695 ' N ' HD13 ' B' ' 56' ' ' LEU . 35.9 t70 -67.88 -26.08 65.83 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.575 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -57.93 -33.66 69.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.848 0.356 . . . . 0.0 110.607 -179.87 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.895 ' HE2' HD21 ' B' ' 83' ' ' LEU . 0.3 OUTLIER -75.18 -54.26 7.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.581 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.589 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 1.9 mtm -61.63 -40.25 94.2 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.747 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.9 OUTLIER -60.1 -54.27 47.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.486 179.587 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.641 ' O ' HD22 ' B' ' 65' ' ' LEU . 0.0 OUTLIER -80.54 2.12 26.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.488 179.754 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.882 ' O ' HD13 ' B' ' 63' ' ' LEU . 1.9 tm? -45.98 -29.95 1.63 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.87 0.367 . . . . 0.0 111.269 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -67.03 74.3 0.11 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.833 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.835 HD21 ' ND2' ' B' ' 78' ' ' ASN . 3.6 mm? -91.11 71.11 6.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.854 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 65.73 -76.42 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.992 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 1.4 m -56.62 131.48 49.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.937 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.29 126.24 55.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.913 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 123.87 -40.17 2.01 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.567 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.438 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 2.1 mm-40 -134.02 169.39 17.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 111.04 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.91 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.76 -133.48 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.642 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.728 ' HB2' ' O ' ' B' ' 71' ' ' LEU . 20.7 t70 160.36 165.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 118.93 0.786 . . . . 0.0 111.079 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.627 ' CG ' HG11 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -46.43 -56.4 5.97 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.303 -179.546 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.562 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 23.6 tp60 -79.07 -33.25 44.74 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.416 -0.513 . . . . 0.0 110.489 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.91 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.3 OUTLIER -44.8 -31.97 1.4 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.872 0.368 . . . . 0.0 110.317 179.361 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.649 ' HD1' HD12 ' B' ' 71' ' ' LEU . 1.5 m-85 -80.49 -54.62 5.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.787 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.606 HD22 HD22 ' A' ' 77' ' ' LEU . 7.2 mt -61.72 -33.76 74.6 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.716 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.835 ' ND2' HD21 ' B' ' 65' ' ' LEU . 0.1 OUTLIER -71.86 -36.7 70.19 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.862 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 1.3 mp -65.67 -57.7 7.45 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.74 -41.85 47.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.781 0.324 . . . . 0.0 110.496 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -49.95 52.3 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.439 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.74 -37.08 42.1 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.64 178.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.895 HD21 ' HE2' ' B' ' 59' ' ' MET . 5.4 mt -62.69 -47.43 83.68 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.548 ' HB2' ' CG2' ' A' ' 10' ' ' ILE . . . -55.62 -30.7 61.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.172 0.511 . . . . 0.0 111.461 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.632 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.2 -17.37 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.785 -179.02 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.675 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -115.49 7.71 15.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.533 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.444 ' HB3' ' CE2' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -145.72 -42.78 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.009 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 12.8 m-70 -85.9 176.41 8.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.808 0.337 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.53 103.42 2.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.942 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.507 ' O ' HG21 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -170.45 -56.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.871 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.436 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -125.37 -44.45 1.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.878 179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 9.6 p -73.94 -24.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.285 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.18 -18.66 14.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.262 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -92.82 17.47 10.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.469 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.544 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -178.46 62.1 0.15 Allowed Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.746 0.308 . . . . 0.0 111.08 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.455 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 47.1 Cg_exo -57.72 -46.91 23.68 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.602 2.201 . . . . 0.0 112.53 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 84.3 Cg_endo -82.73 -2.66 11.02 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.409 2.073 . . . . 0.0 112.576 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.544 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.5 OUTLIER -106.26 89.31 3.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.87 0.366 . . . . 0.0 110.906 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.14 99.53 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -148.98 152.99 37.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.889 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 15.9 t80 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.141 -0.933 . . . . 0.0 110.929 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.796 0.331 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -131.71 118.12 16.61 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.885 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.56 -101.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.699 2.266 . . . . 0.0 112.193 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.673 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -160.94 146.52 14.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.394 0.616 . . . . 0.0 111.207 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -44.04 9.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.348 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.849 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.5 m -68.67 -38.15 80.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.275 179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.673 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.2 OUTLIER -52.04 -37.13 52.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.68 179.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.38 -26.77 41.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.816 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.473 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.34 66.8 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.392 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.088 HG22 HD11 ' A' ' 14' ' ' ILE . 2.1 mp -61.01 -57.01 14.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.69 0.281 . . . . 0.0 111.066 -179.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.906 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -53.84 -27.57 30.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.183 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.56 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -62.7 -55.5 26.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.781 -179.54 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.018 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -71.35 -41.76 69.36 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.088 HD11 HG22 ' A' ' 10' ' ' ILE . 5.0 mt -56.11 -29.33 26.97 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.708 0 CA-C-O 121.083 0.468 . . . . 0.0 112.128 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.14 -32.89 21.06 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.526 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.018 HG22 ' O ' ' A' ' 13' ' ' LEU . 14.2 m -54.7 -31.4 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.749 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 m-85 -80.34 -58.09 3.3 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.335 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 6.9 mm-40 -48.5 -30.86 5.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.6 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -61.96 -51.36 68.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.866 0.365 . . . . 0.0 110.505 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.682 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -80.42 -32.95 37.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.748 0.785 . . . . 0.0 109.563 178.312 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.587 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . . . -90.4 19.9 4.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.286 -1.325 . . . . 0.0 111.854 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -164.9 -164.76 20.94 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.399 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -177.44 -66.67 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.811 0.338 . . . . 0.0 110.967 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -163.24 31.35 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.865 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.55 130.23 1.29 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.569 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.9 104.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.84 0.352 . . . . 0.0 111.012 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -146.55 81.45 1.57 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.71 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 p -105.91 -23.94 4.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.402 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.26 -176.51 4.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.193 0.521 . . . . 0.0 111.357 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -135.38 -129.07 0.15 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.177 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.673 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -173.86 131.06 0.41 Allowed 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.555 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.526 ' HB3' HD12 ' A' ' 63' ' ' LEU . 4.8 pttt -49.53 -42.58 44.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.776 0.322 . . . . 0.0 110.619 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 1.058 ' HA ' HD23 ' A' ' 36' ' ' LEU . 1.9 m -75.2 -43.12 53.75 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.192 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.518 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.1 mt-10 -55.28 -28.87 56.39 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.402 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.7 19.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.091 178.335 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 1.058 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.7 62.12 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.089 179.996 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 t -81.4 -53.81 5.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.272 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 41' ' ' THR . 0.3 OUTLIER -62.31 -36.02 80.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.296 179.494 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.577 ' HE2' HD13 ' A' ' 43' ' ' LEU . 4.2 ttm -46.67 -36.94 7.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.128 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.665 ' HA ' ' HB2' ' A' ' 44' ' ' ALA . 23.2 m-80 -64.0 -19.33 65.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.186 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.962 HG23 ' HG2' ' A' ' 42' ' ' GLU . 4.6 t -84.12 -30.71 25.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.962 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.0 OUTLIER -135.35 -38.01 0.76 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.191 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.83 HD21 HD11 ' B' ' 10' ' ' ILE . 19.0 mt -104.65 36.09 2.54 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.39 0.614 . . . . 0.0 110.146 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.665 ' HB2' ' HA ' ' A' ' 40' ' ' ASN . . . -79.4 -38.24 35.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.199 -0.909 . . . . 0.0 111.11 -179.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.413 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . . . -53.75 -24.23 14.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.821 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.468 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 3.1 m-85 -100.27 27.11 5.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.784 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.5 p -152.11 -42.41 0.11 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.059 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HG2' ' HA ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -37.79 -83.82 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.708 -179.774 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -93.5 -56.17 3.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.964 0.411 . . . . 0.0 110.333 179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.561 ' NE2' HG21 ' A' ' 55' ' ' VAL . 5.9 mm100 55.18 168.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.522 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 19.1 mttt -108.33 -28.89 9.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.491 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.503 ' HB2' HG23 ' A' ' 55' ' ' VAL . 23.2 m-20 -121.08 116.09 31.37 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.777 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -66.03 -7.11 16.02 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.556 2.171 . . . . 0.0 112.683 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.75 -19.73 55.59 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.119 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.561 HG21 ' NE2' ' A' ' 50' ' ' GLN . 85.6 t -49.27 -54.85 5.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.968 0.384 . . . . 0.0 111.285 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.756 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -69.39 -51.61 34.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.298 0.57 . . . . 0.0 110.208 179.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.756 ' N ' HD23 ' A' ' 56' ' ' LEU . 2.9 t0 -54.6 -26.71 34.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.607 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.99 -53.03 62.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.663 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.859 ' CE ' HD21 ' A' ' 83' ' ' LEU . 2.5 ptp -60.54 -53.73 53.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.01 0.433 . . . . 0.0 110.456 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.67 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.3 mtm -60.32 -32.43 71.23 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.757 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.4 ' CG ' ' O ' ' A' ' 57' ' ' ASP . 8.2 mtpp -73.83 -57.35 4.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.881 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.8 mmtm -80.25 6.18 12.6 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.574 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.744 HD23 ' N ' ' A' ' 64' ' ' ASP . 0.2 OUTLIER -58.97 -15.92 15.41 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.808 -0.178 . . . . 0.0 111.479 -179.853 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.744 ' N ' HD23 ' A' ' 63' ' ' LEU . 13.5 t70 -67.99 66.33 0.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.931 0.395 . . . . 0.0 110.888 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.86 HD23 ' HG2' ' A' ' 75' ' ' GLU . 3.3 mm? -89.91 -44.93 9.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.374 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.08 108.81 6.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.768 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t -72.33 73.74 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.98 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.34 -28.82 6.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.012 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 134.28 -30.42 2.91 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.342 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.564 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.4 OUTLIER -122.39 -171.29 2.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.487 0.184 . . . . 0.0 110.609 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -63.71 -140.45 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 178.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.51 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.6 OUTLIER 165.61 175.66 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.256 0.55 . . . . 0.0 111.392 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.865 ' CD1' HG11 ' B' ' 85' ' ' VAL . 0.8 OUTLIER -46.05 -61.81 1.6 Allowed 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -177.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.585 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -80.18 -30.43 38.81 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.267 -179.35 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.4 OUTLIER -46.58 -31.35 2.75 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.531 -0.468 . . . . 0.0 109.784 179.397 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.589 ' HB3' ' CD1' ' A' ' 17' ' ' PHE . 0.8 OUTLIER -79.36 -54.38 6.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.771 178.332 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.52 ' HG ' ' CE2' ' A' ' 17' ' ' PHE . 6.3 mt -61.07 -34.04 74.28 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.617 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.67 ' ND2' HD21 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -72.38 -34.57 68.02 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 179.054 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.847 ' HA ' ' HB2' ' A' ' 59' ' ' MET . 0.3 OUTLIER -67.83 -57.83 5.61 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.685 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.973 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.27 -43.77 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.208 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.112 178.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.02 -50.35 51.66 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.445 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.81 -37.32 43.25 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.659 177.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.859 HD21 ' CE ' ' A' ' 59' ' ' MET . 7.6 mt -64.01 -45.46 88.85 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.737 0.303 . . . . 0.0 110.219 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 88' ' ' HIS . . . -55.25 -32.75 62.58 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.338 0.59 . . . . 0.0 110.688 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.883 HG11 ' CD1' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.31 -17.48 9.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.666 -179.487 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -113.32 12.08 18.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.299 -179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.92 -39.67 0.07 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.677 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.468 ' NE2' ' CE2' ' A' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.61 12.26 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.774 0.321 . . . . 0.0 111.19 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.7 89.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.152 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.415 ' H ' HG22 ' A' ' 92' ' ' VAL . 1.1 m 176.55 107.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.664 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.752 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 75.88 -48.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 85' ' ' VAL . 31.2 m -44.41 -29.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.885 0.374 . . . . 0.0 111.654 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.94 -39.58 15.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.061 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.03 28.91 4.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.406 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.657 ' HB3' ' CD ' ' A' ' 96' ' ' PRO . . . -73.15 -65.82 0.63 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.162 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.657 ' CD ' ' HB3' ' A' ' 95' ' ' ALA . 1.9 Cg_endo -39.08 -55.52 1.43 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 123.38 2.72 . . . . 0.0 113.221 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.6 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 81.0 Cg_exo -42.71 -39.22 7.09 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.514 2.143 . . . . 0.0 112.731 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.58 -31.85 64.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.4 tttt 60.27 -169.0 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.835 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -149.38 174.79 12.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.876 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.915 -179.949 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.805 0.336 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -131.74 118.17 16.59 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.845 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.52 -101.81 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.807 2.338 . . . . 0.0 112.192 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.661 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -161.03 146.48 14.28 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.392 0.615 . . . . 0.0 111.171 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -44.89 -43.95 9.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.326 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.853 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.5 m -68.77 -38.08 79.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.277 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.661 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.2 OUTLIER -52.12 -37.04 52.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.667 179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -26.88 42.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.802 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.468 ' SG ' HG11 ' A' ' 16' ' ' VAL . 0.8 OUTLIER -68.65 -47.39 66.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.397 -179.439 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.056 HG22 HD11 ' B' ' 14' ' ' ILE . 2.1 mp -60.96 -56.9 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 120.768 0.318 . . . . 0.0 111.132 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.904 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -54.0 -27.51 32.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.19 -179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -62.67 -55.54 25.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.817 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 1.024 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -71.37 -41.72 69.36 Favored 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.056 HD11 HG22 ' B' ' 10' ' ' ILE . 5.0 mt -56.1 -29.3 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 121.913 -0.492 . . . . 0.0 112.136 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.13 -32.84 21.09 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.554 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 1.024 HG22 ' O ' ' B' ' 13' ' ' LEU . 14.4 m -54.74 -31.4 24.03 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.74 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 m-85 -80.28 -58.16 3.27 Favored 'General case' 0 C--O 1.227 -0.122 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.373 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.783 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 6.9 mm-40 -48.56 -30.73 5.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.622 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 tppt? -62.06 -51.31 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.873 0.368 . . . . 0.0 110.495 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.679 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.31 -33.05 37.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.804 0.812 . . . . 0.0 109.631 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.599 ' HB2' ' HB2' ' B' ' 30' ' ' LEU . . . -90.42 20.04 4.8 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.213 -1.358 . . . . 0.0 111.743 -178.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -165.02 -164.75 21.05 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.406 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -177.44 -66.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.351 . . . . 0.0 110.994 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -163.25 31.3 0.09 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.883 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.58 130.35 1.3 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.541 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 60.77 104.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.86 0.362 . . . . 0.0 110.975 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 3.1 p -146.6 81.49 1.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.743 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 10.6 p -105.93 -23.91 4.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.361 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 37.5 p -140.22 -176.4 4.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.192 0.52 . . . . 0.0 111.363 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.679 HD11 ' HB2' ' B' ' 20' ' ' TYR . 0.0 OUTLIER -135.48 -129.14 0.15 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.183 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.67 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -173.82 131.04 0.42 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.525 ' HB3' HD12 ' B' ' 63' ' ' LEU . 4.8 pttt -49.49 -42.62 43.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.82 0.343 . . . . 0.0 110.643 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 1.017 ' HA ' HD23 ' B' ' 36' ' ' LEU . 1.9 m -75.18 -43.14 53.87 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.256 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.509 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.1 mt-10 -55.13 -28.98 56.62 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.401 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.3 OUTLIER -80.89 -43.72 19.44 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.038 178.398 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 1.017 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -71.14 -23.84 62.15 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.987 -179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.409 ' N ' ' O ' ' B' ' 33' ' ' THR . 2.1 t -81.31 -53.8 6.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.309 179.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.883 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -62.44 -35.86 80.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.363 179.553 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.558 ' HE2' HD13 ' B' ' 43' ' ' LEU . 4.1 ttm -46.79 -36.87 7.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.005 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.659 ' HA ' ' HB2' ' B' ' 44' ' ' ALA . 23.2 m-80 -64.01 -19.46 65.2 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.952 HG23 ' HG2' ' B' ' 42' ' ' GLU . 4.5 t -83.94 -30.82 25.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.0 OUTLIER -135.4 -37.94 0.76 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -178.118 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.826 HD21 HD11 ' A' ' 10' ' ' ILE . 19.0 mt -104.68 36.07 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.41 0.624 . . . . 0.0 110.184 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.659 ' HB2' ' HA ' ' B' ' 40' ' ' ASN . . . -79.37 -38.23 35.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.14 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . 0.404 ' HA ' ' HG2' ' B' ' 48' ' ' LYS . . . -53.69 -24.32 14.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.805 179.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.459 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 3.1 m-85 -100.25 27.12 5.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.77 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 82.6 p -152.1 -42.42 0.11 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.042 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.404 ' HG2' ' HA ' ' B' ' 45' ' ' ALA . 0.0 OUTLIER -37.83 -83.88 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.691 -179.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -93.36 -56.22 3.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.968 0.413 . . . . 0.0 110.369 179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.547 HE21 HG21 ' B' ' 55' ' ' VAL . 5.8 mm100 55.27 168.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.462 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -108.34 -28.8 9.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.592 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.515 ' HB2' HG23 ' B' ' 55' ' ' VAL . 23.6 m-20 -121.09 116.22 31.29 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.762 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -66.06 -7.11 16.09 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.571 2.18 . . . . 0.0 112.649 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.76 -19.7 55.66 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.087 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.547 HG21 HE21 ' B' ' 50' ' ' GLN . 86.6 t -49.38 -54.84 5.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 117.019 0.409 . . . . 0.0 111.261 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.755 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -69.35 -51.72 34.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 110.175 179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.755 ' N ' HD23 ' B' ' 56' ' ' LEU . 2.9 t0 -54.5 -26.85 33.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.612 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -58.9 -53.08 62.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.617 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.87 ' CE ' HD21 ' B' ' 83' ' ' LEU . 2.5 ptp -60.56 -53.8 53.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.373 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.699 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.2 mtm -60.26 -32.44 71.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.75 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.4 ' CG ' ' O ' ' B' ' 57' ' ' ASP . 8.2 mtpp -73.91 -57.32 4.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.797 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.4 ' O ' HD22 ' B' ' 65' ' ' LEU . 26.8 mmtm -80.24 6.21 12.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.585 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.743 HD23 ' N ' ' B' ' 64' ' ' ASP . 0.2 OUTLIER -59.02 -15.85 15.41 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 111.514 0.191 . . . . 0.0 111.514 -179.87 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.743 ' N ' HD23 ' B' ' 63' ' ' LEU . 13.5 t70 -68.05 66.26 0.1 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.919 0.39 . . . . 0.0 110.901 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.862 HD23 ' HG2' ' B' ' 75' ' ' GLU . 3.3 mm? -89.85 -44.9 9.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.361 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.06 108.88 6.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.804 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -72.38 73.82 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.005 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.34 -29.01 6.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.013 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 134.3 -30.31 2.93 Favored Glycine 0 C--N 1.33 0.221 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.299 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.583 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER -122.51 -171.21 2.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.485 0.183 . . . . 0.0 110.536 -179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 1.038 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -63.7 -140.45 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.506 ' O ' ' CE2' ' B' ' 76' ' ' PHE . 0.6 OUTLIER 165.66 175.7 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.177 0.513 . . . . 0.0 111.428 178.733 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.883 ' CD1' HG11 ' A' ' 85' ' ' VAL . 0.9 OUTLIER -46.04 -61.8 1.6 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -177.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.582 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -80.29 -30.42 38.28 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.211 -179.266 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 1.038 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.4 OUTLIER -46.45 -31.49 2.72 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.479 -0.488 . . . . 0.0 109.873 179.331 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.593 ' HB3' ' CD1' ' B' ' 17' ' ' PHE . 0.8 OUTLIER -79.18 -54.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 120.462 -0.495 . . . . 0.0 109.818 178.242 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.526 ' HG ' ' CZ ' ' B' ' 17' ' ' PHE . 6.3 mt -60.96 -34.02 74.11 Favored 'General case' 0 C--N 1.334 -0.077 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.716 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.663 ' ND2' HD21 ' B' ' 65' ' ' LEU . 0.2 OUTLIER -72.44 -34.55 67.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.043 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.829 ' HA ' ' HB2' ' B' ' 59' ' ' MET . 0.3 OUTLIER -67.86 -57.82 5.62 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.645 -179.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.981 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.23 -43.77 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.135 178.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -53.1 -50.34 52.0 Favored Glycine 0 N--CA 1.45 -0.395 0 N-CA-C 110.126 -1.19 . . . . 0.0 110.126 178.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.438 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.86 -37.34 43.67 Favored Glycine 0 CA--C 1.52 0.405 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.633 178.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.87 HD21 ' CE ' ' B' ' 59' ' ' MET . 7.7 mt -64.02 -45.34 89.34 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 120.773 0.321 . . . . 0.0 110.253 179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.457 ' HA ' ' CD2' ' B' ' 88' ' ' HIS . . . -55.32 -32.78 62.76 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.3 0.572 . . . . 0.0 110.663 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.865 HG11 ' CD1' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.34 -17.29 9.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.727 -179.508 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.535 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -113.41 12.1 18.67 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.368 -179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . . . . . . . . . 6.9 t -157.89 -39.66 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.678 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.459 ' NE2' ' CE2' ' B' ' 46' ' ' PHE . 17.5 m-70 -91.02 167.63 12.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.819 0.343 . . . . 0.0 111.143 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -56.69 89.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.154 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.409 ' H ' HG22 ' B' ' 92' ' ' VAL . 1.1 m 176.54 107.33 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.626 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.749 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER 75.91 -49.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.156 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.441 HG13 ' O ' ' B' ' 85' ' ' VAL . 30.9 m -44.38 -29.55 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.13 0 CA-C-O 120.862 0.363 . . . . 0.0 111.663 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.93 -39.58 15.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.093 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -101.04 28.88 4.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.381 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.656 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . . . -73.1 -65.79 0.64 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.216 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.656 ' CD ' ' HB3' ' B' ' 95' ' ' ALA . 1.9 Cg_endo -39.12 -55.52 1.44 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.483 2.789 . . . . 0.0 113.193 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.599 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 80.6 Cg_exo -42.78 -39.24 7.26 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.648 2.232 . . . . 0.0 112.689 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -31.94 64.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.974 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.5 tttt 60.29 -168.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.861 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 6.3 ptp85 -149.34 174.76 12.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.876 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.4 t80 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.203 -0.904 . . . . 0.0 110.894 -179.996 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.787 0.327 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.449 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -135.77 91.12 18.24 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.874 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 2' ' ' ARG . 22.7 Cg_endo -55.62 -83.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.915 2.41 . . . . 0.0 112.832 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.641 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -109.93 146.64 34.86 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.482 0.658 . . . . 0.0 111.392 -179.804 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 6' ' ' THR . 0.7 OUTLIER -45.01 -48.24 11.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.303 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.9 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.7 m -65.26 -39.7 92.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.385 179.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.641 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.3 mm-40 -51.76 -45.91 63.88 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.498 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -26.78 60.93 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.569 ' SG ' HG11 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -63.6 -52.31 61.48 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.956 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.022 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -55.69 -57.12 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-O 120.694 0.283 . . . . 0.0 111.056 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.881 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.8 OUTLIER -54.59 -27.42 38.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.025 0.44 . . . . 0.0 110.756 179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.789 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -63.07 -55.51 24.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.081 -179.467 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' B' ' 13' ' ' LEU . 4.0 mm? -72.14 -30.97 65.55 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.022 HD11 HG22 ' A' ' 10' ' ' ILE . 5.5 mt -69.8 -38.25 75.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 111.95 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.09 -34.65 64.06 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.678 -1.147 . . . . 0.0 112.023 -176.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 15.9 m -52.27 -40.0 29.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 N-CA-C 107.85 -1.166 . . . . 0.0 107.85 177.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.506 ' N ' HG23 ' A' ' 16' ' ' VAL . 31.3 t80 -72.85 -58.21 3.5 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.296 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.793 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 2.0 mm-40 -49.09 -49.02 43.74 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.54 -51.28 21.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.525 -178.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.502 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.6 m-85 -80.59 -26.87 37.61 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.59 0.709 . . . . 0.0 110.206 178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.748 ' HB1' ' O ' ' A' ' 29' ' ' THR . . . -90.39 20.07 4.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.781 -179.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -121.21 90.81 0.46 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.556 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.39 43.3 2.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.845 0.355 . . . . 0.0 110.872 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.45 114.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.941 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.07 156.1 28.05 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.552 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 66.08 -75.55 0.05 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.789 0.328 . . . . 0.0 111.014 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 61.22 19.38 10.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.232 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.8 m -144.25 17.63 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.361 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.748 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 24.1 p -155.17 -176.91 6.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.989 0.423 . . . . 0.0 110.812 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.551 HD22 ' N ' ' A' ' 31' ' ' SER . 0.3 OUTLIER -147.78 -123.16 0.06 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.261 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.551 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -173.7 129.23 0.41 Allowed 'General case' 0 C--O 1.231 0.088 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.408 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -49.91 -40.71 44.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.165 -179.136 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.711 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.44 -42.72 67.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.936 0.398 . . . . 0.0 110.041 179.624 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.524 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.0 mt-10 -56.01 -29.65 60.68 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' CE1' ' CZ ' ' A' ' 76' ' ' PHE . 0.2 OUTLIER -68.62 -34.88 76.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.535 178.441 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.711 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -53.37 -59.08 5.03 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.699 0.761 . . . . 0.0 111.192 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' HG22 ' A' ' 41' ' ' THR . 3.0 t -57.88 -27.75 63.56 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.407 -1.27 . . . . 0.0 111.34 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' B' ' 6' ' ' THR . 8.7 t80 -57.69 -50.39 73.35 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 121.012 0.434 . . . . 0.0 110.267 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.719 ' HE3' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.39 -44.14 95.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.444 0.64 . . . . 0.0 110.107 179.05 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.44 -19.29 64.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.932 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 37' ' ' SER . 8.3 t -107.61 -52.69 2.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' N ' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -128.09 29.2 5.42 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -177.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.719 HD13 ' HE3' ' A' ' 39' ' ' MET . 7.8 mt -166.7 45.8 0.06 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.17 0.51 . . . . 0.0 110.604 179.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.427 ' O ' ' N ' ' A' ' 48' ' ' LYS . . . -74.87 -30.0 61.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.361 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.47 -29.49 61.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.879 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.412 ' CD1' HD22 ' A' ' 43' ' ' LEU . 4.4 m-85 -83.28 -4.63 58.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.122 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.702 HG21 ' HB3' ' A' ' 39' ' ' MET . 1.4 p -127.16 -11.23 5.86 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.668 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' N ' ' O ' ' A' ' 44' ' ' ALA . 9.2 mttp -59.59 139.75 56.92 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.758 0.313 . . . . 0.0 110.758 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 78.81 -47.83 0.42 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.005 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.17 26.71 4.37 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 110.98 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -66.54 -31.99 73.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.512 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.93 86.69 9.29 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.657 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -83.41 37.58 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.838 2.359 . . . . 0.0 112.835 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.575 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -135.54 4.33 4.03 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.947 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' A' ' 86' ' ' ALA . 48.9 t -85.22 -63.5 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.918 0.39 . . . . 0.0 111.523 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.665 HD23 ' C ' ' A' ' 56' ' ' LEU . 7.0 tt -75.16 -52.15 11.66 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.969 -179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.411 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 1.6 t0 -55.48 -26.81 44.66 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.028 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.575 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -66.57 -53.79 30.68 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -179.329 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.696 ' HG2' ' HA ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -75.55 -43.09 50.41 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -179.11 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.678 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -64.43 -45.38 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.664 -179.251 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 47.0 mmtt -70.53 -52.06 24.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.98 0.419 . . . . 0.0 110.479 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -80.36 6.47 12.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.341 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.678 HD22 ' O ' ' A' ' 60' ' ' MET . 1.2 pt? -44.7 -26.65 0.4 Allowed 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.648 ' H ' HD23 ' A' ' 63' ' ' LEU . 2.3 p30 -70.94 64.51 0.33 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.889 0.376 . . . . 0.0 110.48 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.584 HD23 ' C ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -103.63 -39.59 6.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.031 -179.73 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -115.67 -40.41 3.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.35 -178.64 5.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.765 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -146.13 34.15 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.883 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.31 -79.6 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.505 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 30' ' ' LEU . 1.5 mm-40 -87.33 179.63 6.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.891 0.377 . . . . 0.0 111.109 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.588 HD22 HD12 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -69.37 -137.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.635 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 2.5 t70 173.72 161.49 0.16 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 118.466 0.575 . . . . 0.0 110.879 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.939 ' CD2' HG11 ' B' ' 85' ' ' VAL . 51.5 p90 -55.39 -58.85 6.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.289 -179.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.599 ' O ' ' N ' ' A' ' 78' ' ' ASN . 0.2 OUTLIER -79.96 -22.59 42.44 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 119.824 -0.751 . . . . 0.0 110.516 -179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.5 mt-10 -44.76 -38.09 4.22 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.506 ' CZ ' ' CE1' ' A' ' 35' ' ' PHE . 1.4 t80 -76.84 -54.71 6.25 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 177.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' B' ' 77' ' ' LEU . 0.0 OUTLIER -48.55 -33.94 10.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.599 ' N ' ' O ' ' A' ' 74' ' ' GLN . 0.9 OUTLIER -76.38 -52.39 9.99 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.686 178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.978 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 0.1 OUTLIER -58.5 -59.07 5.95 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.951 -179.073 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.24 -41.41 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 O-C-N 123.606 0.566 . . . . 0.0 111.212 179.492 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.459 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.83 -50.82 48.55 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 119.68 -1.247 . . . . 0.0 110.22 178.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.489 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -60.71 -35.91 90.66 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 120.455 -0.879 . . . . 0.0 111.846 177.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.978 ' HG ' ' O ' ' A' ' 79' ' ' LEU . 12.8 mt -63.92 -38.32 90.66 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.607 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.3 -35.73 65.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.095 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.938 HG11 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.59 -17.81 9.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.653 -1.158 . . . . 0.0 111.67 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -113.86 16.14 18.46 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.163 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.406 ' N ' ' O ' ' A' ' 83' ' ' LEU . 45.1 t -162.76 -42.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.825 -179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -99.01 78.78 2.29 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.909 0.385 . . . . 0.0 111.855 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' ' CB ' ' A' ' 90' ' ' SER . 6.0 mp0 53.37 -163.94 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.292 179.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.405 ' CB ' ' O ' ' A' ' 89' ' ' GLU . 3.2 m 81.7 -69.56 0.08 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.247 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.57 -37.52 4.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.054 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 92' ' ' VAL . 4.2 m -65.29 -27.08 41.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.408 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.42 -29.01 15.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.89 -30.18 70.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.116 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -154.86 66.85 5.15 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.037 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.455 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 50.7 Cg_exo -57.49 -47.16 23.04 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.761 2.308 . . . . 0.0 112.569 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.455 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 98.0 Cg_endo -79.96 -25.34 5.19 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.358 2.039 . . . . 0.0 112.368 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.746 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -67.75 85.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.933 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.65 168.04 2.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.7 -62.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.805 0.336 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.444 ' HA ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -135.74 91.1 18.33 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.921 179.984 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' B' ' 2' ' ' ARG . 22.3 Cg_endo -55.74 -83.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.905 2.403 . . . . 0.0 112.834 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.651 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -109.85 146.51 34.95 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.429 0.633 . . . . 0.0 111.476 -179.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' B' ' 6' ' ' THR . 0.7 OUTLIER -44.96 -48.25 11.4 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.255 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.92 ' O ' HD12 ' B' ' 10' ' ' ILE . 20.1 m -65.31 -39.69 92.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.326 179.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.651 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.3 mm-40 -51.74 -45.87 63.83 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.458 -179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -26.77 60.86 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.563 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.2 OUTLIER -63.48 -52.41 61.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.032 179.791 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.124 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -55.6 -57.07 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 120.638 0.256 . . . . 0.0 111.117 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.861 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.8 OUTLIER -54.67 -27.43 40.12 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.009 0.433 . . . . 0.0 110.729 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.804 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.1 OUTLIER -63.05 -55.52 24.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.084 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 1.05 HD23 HD23 ' A' ' 13' ' ' LEU . 4.0 mm? -72.16 -31.02 65.56 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -178.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.124 HD11 HG22 ' B' ' 10' ' ' ILE . 5.6 mt -69.8 -38.2 75.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.344 0.592 . . . . 0.0 111.902 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.18 -34.58 63.82 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.963 -176.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.96 HG22 ' O ' ' B' ' 13' ' ' LEU . 16.0 m -52.27 -40.07 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 177.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.502 ' N ' HG23 ' B' ' 16' ' ' VAL . 31.4 t80 -72.77 -58.1 3.6 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 114.394 -1.275 . . . . 0.0 110.422 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 2.0 mm-40 -49.32 -48.84 46.04 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.28 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.66 -51.25 22.28 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.511 -178.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.521 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.6 m-85 -80.53 -26.9 37.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.521 0.677 . . . . 0.0 110.144 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' B' ' 29' ' ' THR . . . -90.4 20.03 4.8 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.705 -179.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -121.11 90.73 0.46 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.594 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.5 43.43 2.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.964 0.411 . . . . 0.0 110.911 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 62.27 114.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.971 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.09 156.0 28.01 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.646 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 66.09 -75.66 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.719 0.295 . . . . 0.0 110.972 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 61.37 19.34 10.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 14.6 m -144.21 17.69 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.402 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.744 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 24.2 p -155.16 -176.98 6.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.016 0.436 . . . . 0.0 110.839 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.558 HD22 ' N ' ' B' ' 31' ' ' SER . 0.3 OUTLIER -147.74 -123.2 0.06 Allowed 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.31 179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.558 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.3 OUTLIER -173.66 129.21 0.42 Allowed 'General case' 0 C--O 1.231 0.116 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.32 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.413 ' N ' ' CD2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -49.8 -40.79 42.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.19 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.722 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.34 -42.77 68.12 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.075 179.591 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.511 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.0 mt-10 -55.92 -29.77 60.58 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -68.57 -34.86 76.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.521 178.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.722 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -53.4 -59.12 4.99 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 111.123 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.525 ' O ' HG22 ' B' ' 41' ' ' THR . 3.0 t -57.84 -27.74 63.47 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.389 -1.278 . . . . 0.0 111.386 -178.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.656 ' HE1' HG21 ' A' ' 6' ' ' THR . 8.6 t80 -57.64 -50.49 72.99 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.979 0.418 . . . . 0.0 110.26 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.698 ' HB3' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -60.32 -44.07 95.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.438 0.637 . . . . 0.0 110.147 179.064 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -63.5 -19.29 64.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.92 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.525 HG22 ' O ' ' B' ' 37' ' ' SER . 8.2 t -107.68 -52.59 2.74 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.451 ' N ' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -128.16 29.2 5.41 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -177.158 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.667 HD13 ' HE3' ' B' ' 39' ' ' MET . 7.8 mt -166.7 45.81 0.06 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.138 0.494 . . . . 0.0 110.604 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' B' ' 48' ' ' LYS . . . -74.83 -29.95 61.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.431 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.49 -29.5 61.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.856 179.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.42 ' CD1' HD22 ' B' ' 43' ' ' LEU . 4.4 m-85 -83.32 -4.61 58.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.201 179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.698 HG21 ' HB3' ' B' ' 39' ' ' MET . 1.4 p -127.1 -11.19 5.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.705 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' B' ' 44' ' ' ALA . 9.3 mttp -59.55 139.7 56.92 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 78.84 -47.84 0.42 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.16 26.71 4.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.001 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -66.56 -32.07 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.89 86.63 9.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.645 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.43 37.65 0.67 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.799 2.333 . . . . 0.0 112.809 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.585 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -135.56 4.32 4.02 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.964 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.596 HG13 ' HB3' ' B' ' 86' ' ' ALA . 49.1 t -85.27 -63.42 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-O 120.912 0.386 . . . . 0.0 111.534 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.655 HD23 ' C ' ' B' ' 56' ' ' LEU . 7.0 tt -75.11 -52.23 11.52 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.976 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.401 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 1.6 t0 -55.52 -26.77 44.91 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.02 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.585 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -66.59 -53.75 31.04 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.705 ' HG2' ' HA ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -75.53 -43.09 50.63 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.676 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -64.47 -45.28 88.04 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.683 -179.234 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 47.1 mmtt -70.61 -52.04 24.11 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.911 0.386 . . . . 0.0 110.429 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -80.42 6.55 11.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.338 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.676 HD22 ' O ' ' B' ' 60' ' ' MET . 1.2 pt? -44.68 -26.63 0.4 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.654 ' H ' HD23 ' B' ' 63' ' ' LEU . 2.3 p30 -70.97 64.5 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.934 0.397 . . . . 0.0 110.469 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.578 HD23 ' C ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER -103.71 -39.48 6.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.047 -179.711 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -115.7 -40.53 3.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.18 -178.57 5.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.84 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -146.18 34.11 0.99 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.855 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.18 -79.59 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.552 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.417 ' NE2' ' O ' ' B' ' 30' ' ' LEU . 1.5 mm-40 -87.29 179.56 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.88 0.372 . . . . 0.0 111.167 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.577 HD22 HD12 ' B' ' 63' ' ' LEU . 0.4 OUTLIER -69.25 -137.08 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.674 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 2.5 t70 173.69 161.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 118.409 0.55 . . . . 0.0 110.969 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.938 ' CD2' HG11 ' A' ' 85' ' ' VAL . 51.6 p90 -55.37 -58.83 6.12 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.4 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.584 ' O ' ' N ' ' B' ' 78' ' ' ASN . 0.2 OUTLIER -79.92 -22.55 42.59 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.556 -179.937 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.823 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.5 mt-10 -44.81 -38.11 4.29 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.507 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 1.4 t80 -76.77 -54.71 6.26 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 177.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.9 HD12 HD12 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -48.6 -33.85 10.54 Favored 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 177.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.584 ' N ' ' O ' ' B' ' 74' ' ' GLN . 0.9 OUTLIER -76.48 -52.36 9.96 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.654 178.027 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.973 ' O ' ' HG ' ' B' ' 83' ' ' LEU . 0.1 OUTLIER -58.55 -58.94 6.35 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.977 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.97 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.27 -41.53 65.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 O-C-N 123.572 0.545 . . . . 0.0 111.158 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.455 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.72 -50.82 47.87 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 119.75 -1.215 . . . . 0.0 110.261 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.49 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -60.77 -35.88 90.77 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.847 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.973 ' HG ' ' O ' ' B' ' 79' ' ' LEU . 12.9 mt -63.87 -38.35 90.77 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.608 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.37 -35.58 65.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.098 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.939 HG11 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.54 -17.89 9.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 114.732 -1.122 . . . . 0.0 111.706 -179.538 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.596 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.78 15.98 18.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.13 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.416 ' N ' ' O ' ' B' ' 83' ' ' LEU . 45.3 t -162.74 -42.41 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.852 -179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.404 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.6 OUTLIER -99.12 78.86 2.28 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.923 0.392 . . . . 0.0 111.869 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.411 ' O ' ' CB ' ' B' ' 90' ' ' SER . 6.0 mp0 53.37 -163.99 0.09 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.415 179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.411 ' CB ' ' O ' ' B' ' 89' ' ' GLU . 3.2 m 81.72 -69.64 0.08 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.241 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.51 -37.52 4.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.103 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 m -65.34 -27.06 40.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.364 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.41 -28.95 15.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.006 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.98 -30.13 70.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.059 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.757 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -154.86 66.8 5.14 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.038 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.452 ' N ' ' HD2' ' B' ' 97' ' ' PRO . 50.2 Cg_exo -57.5 -47.12 23.17 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.763 2.309 . . . . 0.0 112.622 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 98.2 Cg_endo -80.01 -25.3 5.16 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.336 2.024 . . . . 0.0 112.324 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.757 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.6 OUTLIER -67.78 85.04 0.21 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.64 168.15 2.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.835 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.75 -62.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.934 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.929 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.487 1.425 0 CA-C-O 120.765 0.317 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.423 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 1.3 mtp180 -89.96 -51.66 0.34 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.032 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 24.9 Cg_exo -67.82 -131.34 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.949 2.433 . . . . 0.0 111.846 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.686 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -172.6 147.01 1.77 Allowed 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.328 0.585 . . . . 0.0 111.049 -179.986 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.76 -46.44 10.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.114 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.999 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.19 -41.76 96.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.18 0.514 . . . . 0.0 109.932 179.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.686 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.5 mt-10 -51.66 -34.71 39.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.918 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.37 -35.43 40.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.842 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.636 ' HB2' HD22 ' B' ' 13' ' ' LEU . 3.4 p -65.45 -40.7 93.54 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.066 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.039 HG22 HD11 ' A' ' 14' ' ' ILE . 2.6 mp -69.89 -56.17 12.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.402 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.1 -27.47 14.18 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.604 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.636 ' O ' HG13 ' A' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.887 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.953 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -59.75 -29.67 68.33 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.118 0.485 . . . . 0.0 112.086 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.039 HD11 HG22 ' A' ' 10' ' ' ILE . 8.0 mt -70.66 -39.04 75.37 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 CA-C-O 121.541 0.686 . . . . 0.0 110.539 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.5 -32.79 58.53 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.297 -1.319 . . . . 0.0 112.293 -176.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.953 HG22 ' O ' ' A' ' 13' ' ' LEU . 25.0 m -52.09 -39.09 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.497 ' N ' HG23 ' A' ' 16' ' ' VAL . 9.1 t80 -77.85 -58.47 3.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.917 179.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 4.6 mm-40 -48.84 -30.97 6.39 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -51.56 68.95 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.804 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.763 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.05 -49.38 10.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.794 0.807 . . . . 0.0 109.962 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' A' ' 30' ' ' LEU . . . -57.25 -52.12 66.62 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.782 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.1 -168.22 2.61 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.53 104.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.787 0.327 . . . . 0.0 110.885 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 60.68 156.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.935 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.17 155.59 31.82 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.474 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -99.83 163.06 12.62 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.835 0.35 . . . . 0.0 110.887 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m 62.43 151.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.934 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.9 m -84.74 60.87 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.064 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 31.7 p -123.57 -178.33 3.99 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.262 0.553 . . . . 0.0 111.031 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.763 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -131.73 -139.86 0.21 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.787 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.516 ' H ' HD22 ' A' ' 30' ' ' LEU . 1.3 p -164.33 136.72 4.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 36' ' ' LEU . 3.4 pttt -49.72 -35.76 23.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.925 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.951 ' HA ' HD23 ' A' ' 36' ' ' LEU . 12.9 m -74.28 -53.18 10.26 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.856 -0.338 . . . . 0.0 111.779 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.462 ' HB3' ' CD1' ' A' ' 20' ' ' TYR . 25.4 mt-10 -55.63 -28.2 53.96 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.54 ' CE2' ' CD2' ' A' ' 76' ' ' PHE . 1.3 t80 -78.18 -43.02 29.73 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.209 178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.951 HD23 ' HA ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -68.23 -21.02 64.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.48 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -80.99 -26.55 36.42 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.141 0.496 . . . . 0.0 109.831 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.464 ' HB2' ' CE2' ' A' ' 20' ' ' TYR . 45.8 t80 -69.5 -24.48 63.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.666 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.593 ' CG ' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -72.44 -41.68 65.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.615 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -73.99 -19.4 60.66 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.4 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.4 p -106.32 -76.53 0.61 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 38' ' ' PHE . 2.0 mm-40 -68.41 -33.15 73.71 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.778 HD22 ' CD2' ' A' ' 46' ' ' PHE . 15.5 mt -121.95 43.73 2.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.074 0.464 . . . . 0.0 110.686 -179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -74.68 -25.02 58.89 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.809 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.08 -23.23 67.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.812 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.778 ' CD2' HD22 ' A' ' 43' ' ' LEU . 16.2 m-85 -95.55 -27.89 15.13 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.915 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.593 HG21 ' CG ' ' A' ' 39' ' ' MET . 11.7 t -125.26 42.59 3.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.839 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.06 -71.65 0.53 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.974 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -89.09 9.81 24.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.455 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 57.22 38.37 28.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.88 0.371 . . . . 0.0 110.997 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -37.67 67.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.944 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.589 ' HB3' HG23 ' A' ' 55' ' ' VAL . 0.9 OUTLIER -131.75 101.91 15.28 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.754 179.861 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -70.34 -0.87 8.03 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.798 2.332 . . . . 0.0 112.943 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -100.38 2.03 56.12 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.707 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.761 HG22 ' O ' ' A' ' 86' ' ' ALA . 23.6 t -84.76 -61.86 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.066 0.46 . . . . 0.0 111.437 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.546 HD13 ' CG ' ' A' ' 39' ' ' MET . 7.8 tp -75.1 -51.23 13.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.735 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.65 -33.76 64.36 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.489 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.571 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -64.27 -40.31 95.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.694 -179.626 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.883 ' CE ' HD21 ' A' ' 83' ' ' LEU . 0.0 OUTLIER -61.69 -54.21 45.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.041 0.448 . . . . 0.0 111.199 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.892 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.75 -29.54 67.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.431 -179.119 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 mmtt -78.12 -57.7 3.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.494 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -80.54 6.12 13.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.695 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.892 HD22 ' O ' ' A' ' 60' ' ' MET . 1.8 pt? -44.82 -31.56 1.27 Allowed 'General case' 0 CA--C 1.518 -0.259 0 CA-C-O 121.062 0.458 . . . . 0.0 111.397 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.565 ' H ' HD23 ' A' ' 63' ' ' LEU . 6.6 t70 40.92 88.63 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.185 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.872 HD21 HD12 ' A' ' 63' ' ' LEU . 2.6 pp -164.27 123.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.936 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.85 24.2 2.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.955 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.43 153.27 34.37 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.662 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.16 -61.07 0.49 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.724 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.27 17.94 4.72 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.769 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.623 HE21 ' HA ' ' A' ' 70' ' ' GLN . 0.4 OUTLIER -150.81 -176.35 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 111.119 -179.99 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.716 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -65.72 -142.5 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.403 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.491 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.3 OUTLIER 171.74 -178.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.23 0.538 . . . . 0.0 111.731 179.121 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 43.5 p90 -61.77 -58.15 9.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.639 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.466 ' NE2' ' N ' ' A' ' 78' ' ' ASN . 43.0 tp60 -74.74 -25.38 59.07 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.608 -179.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.789 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -44.95 -37.57 4.07 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.54 ' CD2' ' CE2' ' A' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.47 5.73 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.833 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.675 HD13 ' HA3' ' B' ' 81' ' ' GLY . 6.5 mt -53.98 -33.89 58.26 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.466 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.79 -50.05 14.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.242 177.874 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.789 HD13 ' O ' ' A' ' 75' ' ' GLU . 5.0 mp -58.05 -57.52 12.47 Favored 'General case' 0 N--CA 1.457 -0.096 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.016 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.732 HD11 HG12 ' B' ' 10' ' ' ILE . 0.1 OUTLIER -71.1 -46.03 68.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.027 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.668 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.91 -50.13 51.96 Favored Glycine 0 C--N 1.333 0.412 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.65 -35.12 37.17 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.38 -0.914 . . . . 0.0 111.687 178.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.883 HD21 ' CE ' ' A' ' 59' ' ' MET . 12.6 mt -61.74 -45.99 91.57 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.965 0.412 . . . . 0.0 109.979 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.48 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.37 -31.81 62.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.873 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.902 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.37 -17.41 9.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.649 -179.598 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.761 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -114.73 13.01 17.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.341 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -157.77 -39.72 0.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.578 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.39 67.15 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.697 0.284 . . . . 0.0 111.737 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.7 -168.2 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 7.9 m 76.09 5.51 3.75 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.652 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.503 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER 170.35 -52.12 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.849 0.357 . . . . 0.0 110.721 179.674 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.1 p -59.17 -27.7 37.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.165 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 7.8 ttpt -60.66 -66.64 0.5 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.889 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.17 -61.88 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.069 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.636 ' HB1' ' HB3' ' A' ' 98' ' ' GLN . . . 54.52 51.16 7.4 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.657 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.565 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 38.2 Cg_exo -57.64 -49.96 11.92 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.984 1.789 . . . . 0.0 111.503 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.557 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 82.5 Cg_endo -87.51 -51.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.478 2.119 . . . . 0.0 111.703 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.636 ' HB3' ' HB1' ' A' ' 95' ' ' ALA . 7.0 pt20 40.11 92.32 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.829 179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.68 115.66 30.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.735 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -93.08 -63.39 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.928 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 24.6 p . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.818 0.342 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.428 ' CB ' ' HD3' ' B' ' 3' ' ' PRO . 1.3 mtp180 -89.89 -51.61 0.34 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.976 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.428 ' HD3' ' CB ' ' B' ' 2' ' ' ARG . 25.0 Cg_exo -67.78 -131.35 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 123.073 2.516 . . . . 0.0 111.86 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.682 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -172.65 146.96 1.74 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.317 0.58 . . . . 0.0 111.142 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.69 -46.48 10.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.094 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.99 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.16 -41.82 97.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.894 179.048 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.682 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.5 mt-10 -51.65 -34.71 39.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.936 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -79.41 -35.38 40.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.757 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.616 ' HB2' HD22 ' A' ' 13' ' ' LEU . 3.4 p -65.62 -40.59 92.77 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.07 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.097 HG22 HD11 ' B' ' 14' ' ' ILE . 2.6 mp -69.85 -56.2 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.412 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.959 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.14 -27.43 14.25 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -178.574 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.638 ' O ' HG13 ' B' ' 16' ' ' VAL . 15.1 m -74.51 -56.01 5.31 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.841 -0.343 . . . . 0.0 111.878 -179.286 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.932 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -59.84 -29.56 68.36 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.12 0.486 . . . . 0.0 112.085 -179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.097 HD11 HG22 ' B' ' 10' ' ' ILE . 8.0 mt -70.73 -38.96 74.99 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-O 121.478 0.656 . . . . 0.0 110.526 179.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.55 -32.8 58.43 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 114.387 -1.279 . . . . 0.0 112.311 -176.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.932 HG22 ' O ' ' B' ' 13' ' ' LEU . 25.2 m -52.15 -39.05 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 177.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.496 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 9.0 t80 -77.9 -58.52 3.22 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.839 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.809 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 4.7 mm-40 -48.91 -30.84 6.36 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -51.65 68.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.702 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.753 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.2 OUTLIER -80.94 -49.39 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.869 0.842 . . . . 0.0 109.995 178.459 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.571 ' CA ' ' HG ' ' B' ' 30' ' ' LEU . . . -57.28 -52.08 66.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.23 -1.35 . . . . 0.0 111.859 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.12 -168.31 2.66 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.483 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.6 104.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.746 0.308 . . . . 0.0 110.951 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 60.83 156.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.94 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 91.22 155.55 31.8 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.442 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -99.75 163.12 12.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.878 0.37 . . . . 0.0 110.874 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.5 m 62.38 151.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.526 ' O ' HG23 ' B' ' 28' ' ' VAL . 26.8 m -84.8 60.9 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.018 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 31.9 p -123.65 -178.36 4.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.248 0.546 . . . . 0.0 111.025 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.753 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -131.63 -139.83 0.21 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.877 179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.496 ' H ' HD22 ' B' ' 30' ' ' LEU . 1.3 p -164.43 136.63 4.7 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.4 pttt -49.59 -35.67 21.52 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.991 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.959 ' HA ' HD23 ' B' ' 36' ' ' LEU . 12.5 m -74.46 -53.06 10.28 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.755 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' ' CD1' ' B' ' 20' ' ' TYR . 25.4 mt-10 -55.68 -28.17 54.14 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.547 ' CE2' ' CD2' ' B' ' 76' ' ' PHE . 1.3 t80 -78.27 -42.95 29.47 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.183 178.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.959 HD23 ' HA ' ' B' ' 33' ' ' THR . 0.3 OUTLIER -68.3 -20.98 64.8 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.474 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 1.4 m -81.03 -26.54 36.31 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.133 0.492 . . . . 0.0 109.832 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB2' ' CE2' ' B' ' 20' ' ' TYR . 45.9 t80 -69.46 -24.54 63.81 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.588 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.6 ' CG ' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -72.39 -41.65 66.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.611 -179.595 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.566 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 0.1 OUTLIER -74.08 -19.34 60.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.349 -179.683 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 28.5 p -106.32 -76.68 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -178.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.454 ' CB ' ' CZ ' ' B' ' 38' ' ' PHE . 2.0 mm-40 -68.33 -33.06 73.61 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -177.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.77 HD22 ' CD2' ' B' ' 46' ' ' PHE . 15.3 mt -122.16 43.93 2.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.134 0.492 . . . . 0.0 110.589 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.566 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -74.69 -25.03 58.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.88 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.05 -23.24 67.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.784 179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.77 ' CD2' HD22 ' B' ' 43' ' ' LEU . 16.2 m-85 -95.59 -27.94 15.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.934 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.6 HG21 ' CG ' ' B' ' 39' ' ' MET . 11.7 t -125.23 42.64 3.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.918 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.13 -71.62 0.53 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.96 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -89.15 9.89 23.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.382 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 57.13 38.54 29.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.862 0.363 . . . . 0.0 110.908 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -37.8 67.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.856 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.611 ' HB3' HG23 ' B' ' 55' ' ' VAL . 0.9 OUTLIER -131.72 101.92 15.32 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.744 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -70.33 -0.84 7.99 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.88 2.387 . . . . 0.0 112.99 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.568 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -100.37 2.02 56.13 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.788 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.773 HG22 ' O ' ' B' ' 86' ' ' ALA . 23.7 t -84.74 -61.9 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.078 0.466 . . . . 0.0 111.426 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.544 HD13 ' CG ' ' B' ' 39' ' ' MET . 7.7 tp -75.06 -51.24 14.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.723 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -55.62 -33.76 64.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.508 -179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -64.26 -40.3 95.72 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.642 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.872 ' CE ' HD21 ' B' ' 83' ' ' LEU . 0.0 OUTLIER -61.78 -54.24 45.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.994 0.426 . . . . 0.0 111.176 -179.4 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.875 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -68.59 -29.62 68.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.48 -179.219 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -78.11 -57.79 3.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' B' ' 62' ' ' LYS . 9.5 mptt -80.49 6.11 13.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.738 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.875 HD22 ' O ' ' B' ' 60' ' ' MET . 1.8 pt? -44.82 -31.52 1.25 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.02 0.438 . . . . 0.0 111.407 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.559 ' H ' HD23 ' B' ' 63' ' ' LEU . 6.6 t70 40.86 88.63 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.165 179.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.873 HD21 HD12 ' B' ' 63' ' ' LEU . 2.6 pp -164.25 123.13 1.89 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.99 24.25 2.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.907 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.45 153.27 34.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.757 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 71.17 -61.02 0.5 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.683 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 17.89 4.77 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.743 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.612 ' HA ' HE21 ' B' ' 70' ' ' GLN . 0.4 OUTLIER -150.71 -176.21 5.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.775 0.321 . . . . 0.0 111.233 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.718 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -65.86 -142.44 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.417 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.485 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.3 OUTLIER 171.75 -178.29 0.06 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.197 0.523 . . . . 0.0 111.799 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.902 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.0 p90 -61.77 -58.22 8.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.648 -178.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.463 ' NE2' ' N ' ' B' ' 78' ' ' ASN . 42.9 tp60 -74.67 -25.37 59.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.623 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.795 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -44.87 -37.63 4.03 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.192 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.547 ' CD2' ' CE2' ' B' ' 35' ' ' PHE . 1.1 t80 -80.14 -54.33 5.86 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.866 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.668 HD13 ' HA3' ' A' ' 81' ' ' GLY . 6.4 mt -54.15 -33.81 58.86 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.463 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.85 -50.02 14.37 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.233 177.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.795 HD13 ' O ' ' B' ' 75' ' ' GLU . 5.0 mp -58.01 -57.65 11.89 Favored 'General case' 0 N--CA 1.456 -0.144 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.955 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.754 HD11 HG12 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -70.94 -46.13 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.071 179.614 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.675 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.89 -50.22 51.43 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.512 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.15 36.5 Favored Glycine 0 CA--C 1.519 0.34 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.68 178.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.872 HD21 ' CE ' ' B' ' 59' ' ' MET . 12.7 mt -61.66 -45.98 91.7 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 121.032 0.444 . . . . 0.0 110.009 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.506 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.39 -31.7 62.02 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.007 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.38 -17.52 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.61 -179.61 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.773 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -114.63 12.96 17.34 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.361 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.474 ' HG ' ' HD1' ' B' ' 46' ' ' PHE . 0.5 OUTLIER -157.79 -39.71 0.07 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.625 -179.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -107.29 67.07 0.68 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 55.75 -168.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.363 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 7.8 m 76.1 5.4 3.75 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.622 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.502 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.2 OUTLIER 170.36 -52.04 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.78 179.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.9 p -59.3 -27.66 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.126 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 7.9 ttpt -60.65 -66.69 0.49 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.08 -61.94 1.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.109 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.622 ' HB1' ' HB3' ' B' ' 98' ' ' GLN . . . 54.57 51.11 7.29 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.636 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.568 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 38.5 Cg_exo -57.61 -49.87 12.21 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 121.994 1.796 . . . . 0.0 111.588 179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.562 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 80.4 Cg_endo -87.59 -51.72 0.03 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 122.567 2.178 . . . . 0.0 111.687 178.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.622 ' HB3' ' HB1' ' B' ' 95' ' ' ALA . 6.9 pt20 40.23 92.22 0.01 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.782 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.55 115.57 30.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.863 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -93.04 -63.49 1.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.807 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.865 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 p . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.852 0.358 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.442 ' CB ' ' CD ' ' A' ' 3' ' ' PRO . 0.5 OUTLIER -169.63 -64.11 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.948 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.442 ' CD ' ' CB ' ' A' ' 2' ' ' ARG . 71.7 Cg_endo -66.06 -99.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.723 2.282 . . . . 0.0 112.33 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.688 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -162.19 145.96 12.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.374 0.607 . . . . 0.0 111.059 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.81 -47.76 10.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.034 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.905 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.9 OUTLIER -63.42 -39.18 93.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.218 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.688 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.6 OUTLIER -52.28 -34.28 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.75 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.39 -39.68 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.01 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' B' ' 13' ' ' LEU . 2.8 p -58.6 -42.47 88.2 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.431 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.041 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -67.5 -56.05 14.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.906 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.88 -27.34 12.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.538 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.549 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.5 m -71.58 -55.84 7.0 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.946 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -63.55 -28.42 69.93 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.041 HD11 HG22 ' A' ' 10' ' ' ILE . 7.5 mt -70.64 -37.01 67.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.574 0.702 . . . . 0.0 110.645 179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.47 -33.08 58.7 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.285 -1.325 . . . . 0.0 112.278 -176.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.946 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.5 m -53.19 -38.95 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 177.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.572 ' CD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -75.25 -57.7 3.73 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.211 -1.359 . . . . 0.0 110.535 179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.796 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -48.87 -30.39 5.78 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.46 -52.12 66.66 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.501 -0.479 . . . . 0.0 111.147 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.882 ' HB3' HD21 ' A' ' 30' ' ' LEU . 17.4 m-85 -81.17 -47.81 12.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.79 0.805 . . . . 0.0 109.839 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.98 -25.05 57.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.27 -1.332 . . . . 0.0 111.645 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.83 158.59 31.39 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.349 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.4 92.93 1.18 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.349 . . . . 0.0 110.955 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.67 -49.04 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.87 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.76 -50.49 0.95 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.506 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -156.53 -67.03 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 110.986 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.0 t 59.1 79.08 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.803 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.28 -17.56 7.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.574 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 16.6 p -139.32 178.73 6.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.127 0.489 . . . . 0.0 111.148 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.882 HD21 ' HB3' ' A' ' 20' ' ' TYR . 1.3 tt -125.27 -115.28 0.29 Allowed 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.968 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.506 ' N ' ' HB2' ' A' ' 71' ' ' LEU . 43.2 t 176.01 129.14 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' HB3' ' HE2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.67 -35.7 22.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.717 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.2 -44.15 54.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.88 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.469 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -58.48 -28.84 65.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 0.0 110.1 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -70.49 -27.95 64.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.917 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.717 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.46 -58.98 5.72 Favored 'General case' 0 CA--C 1.51 -0.596 0 CA-C-O 121.677 0.751 . . . . 0.0 111.121 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.951 ' O ' HG22 ' A' ' 41' ' ' THR . 3.1 m -56.17 -44.09 79.02 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.46 -178.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.435 ' HE1' HG21 ' B' ' 6' ' ' THR . 10.2 t80 -57.57 -29.08 64.13 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.812 0.339 . . . . 0.0 110.748 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -76.52 -41.28 47.38 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.099 0.476 . . . . 0.0 110.759 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 63.3 m-80 -73.67 -19.46 60.82 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.244 -179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.951 HG22 ' O ' ' A' ' 37' ' ' SER . 0.7 OUTLIER -98.18 -66.93 0.87 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.597 ' H ' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -96.29 -20.98 18.12 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -176.172 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.585 HD21 HD11 ' B' ' 10' ' ' ILE . 31.3 mt -120.61 45.89 2.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.203 0.525 . . . . 0.0 110.59 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.82 -32.08 35.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.077 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.47 -23.65 51.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.839 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -90.42 -8.48 50.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.112 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.436 ' CG2' ' HG2' ' A' ' 39' ' ' MET . 6.7 p -112.84 -28.37 7.78 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.008 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -53.7 -79.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.926 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.406 ' O ' ' N ' ' A' ' 51' ' ' LYS . 14.1 m-20 -59.26 -55.54 33.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.323 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.7 -80.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.431 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 49' ' ' ASN . 4.1 ttmt 59.69 25.57 14.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.931 0.395 . . . . 0.0 110.493 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -170.74 106.41 0.41 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.494 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.23 36.74 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.547 2.164 . . . . 0.0 112.801 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.494 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -137.29 5.03 3.51 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.95 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.66 -63.21 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.782 0.325 . . . . 0.0 111.431 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.2 OUTLIER -64.37 -50.37 67.98 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.079 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -55.89 -45.13 78.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 0.0 OUTLIER -58.6 -25.33 62.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.891 0.377 . . . . 0.0 110.967 -179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 1.032 ' HG3' HD21 ' A' ' 83' ' ' LEU . 9.5 mmm -65.62 -54.6 25.46 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.489 0.662 . . . . 0.0 112.006 -179.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.798 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -73.7 -48.69 30.17 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.722 -1.127 . . . . 0.0 112.409 -178.759 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HG3' ' N ' ' A' ' 62' ' ' LYS . 16.9 pttt -66.78 -52.71 40.82 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.687 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.433 ' N ' ' HG3' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -81.1 6.03 14.93 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.383 179.212 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.805 HD23 ' N ' ' A' ' 64' ' ' ASP . 0.7 OUTLIER -47.28 -27.76 1.68 Allowed 'General case' 0 CA--C 1.52 -0.205 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.386 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.805 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.9 OUTLIER 34.18 83.67 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.292 179.62 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.554 ' O ' HD12 ' A' ' 65' ' ' LEU . 4.1 pp -134.57 152.4 51.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.89 0.376 . . . . 0.0 111.14 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -145.25 89.62 1.96 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.42 -50.07 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.724 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.77 36.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.697 179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 69.84 13.78 69.58 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.679 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.0 OUTLIER -119.52 -174.46 2.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.862 0.363 . . . . 0.0 111.15 -179.807 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.4 OUTLIER -69.56 -140.7 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.542 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.6 OUTLIER 173.45 169.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.012 0.434 . . . . 0.0 111.062 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HB2' HG11 ' B' ' 85' ' ' VAL . 2.8 m-85 -59.13 -62.33 1.96 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.91 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.459 ' O ' ' N ' ' A' ' 78' ' ' ASN . 50.0 tp60 -67.84 -28.86 67.91 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.65 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.638 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -44.51 -40.53 5.69 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 110.28 179.7 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' CG2' ' A' ' 16' ' ' VAL . 1.7 t80 -72.05 -53.99 11.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.277 178.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.501 HD21 ' CB ' ' A' ' 13' ' ' LEU . 5.7 mt -54.75 -33.81 61.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.393 0.616 . . . . 0.0 109.512 178.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.459 ' N ' ' O ' ' A' ' 74' ' ' GLN . 1.4 m-20 -74.41 -49.85 20.9 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.38 178.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.891 ' O ' ' HG ' ' A' ' 83' ' ' LEU . 7.3 mp -65.03 -58.29 6.46 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.721 -179.694 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.568 ' CD1' HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -65.91 -46.68 87.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 O-C-N 123.351 0.407 . . . . 0.0 111.259 179.481 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.486 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -55.72 -50.43 60.83 Favored Glycine 0 CA--C 1.506 -0.488 0 N-CA-C 110.012 -1.235 . . . . 0.0 110.012 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.61 -29.89 54.96 Favored Glycine 0 CA--C 1.523 0.54 0 C-N-CA 120.411 -0.9 . . . . 0.0 111.663 177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 1.032 HD21 ' HG3' ' A' ' 59' ' ' MET . 24.6 mt -66.57 -47.32 73.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.075 0.464 . . . . 0.0 110.198 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.587 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.21 -34.71 64.16 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.801 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.498 HG11 ' HB2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.08 -17.56 9.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.31 -179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.06 16.61 16.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.358 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' A' ' 83' ' ' LEU . 22.6 t -163.55 -30.85 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.587 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 57.2 t60 -84.5 51.73 2.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.817 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.64 32.6 0.06 Allowed 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' A' ' 85' ' ' VAL . 0.4 OUTLIER -94.17 -67.03 0.88 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.486 179.623 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.19 -35.96 7.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.337 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.451 HG21 ' HA ' ' A' ' 87' ' ' CYS . 0.0 OUTLIER -57.19 -33.21 42.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.878 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -15.98 64.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.932 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.434 ' C ' ' HD3' ' A' ' 96' ' ' PRO . . . -136.34 58.93 1.72 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.807 0.336 . . . . 0.0 111.263 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.902 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -126.98 64.99 62.28 Favored Pre-proline 0 CA--C 1.531 0.23 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.302 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.449 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 41.1 Cg_exo -58.81 -47.36 18.68 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.651 2.234 . . . . 0.0 112.918 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.449 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 98.4 Cg_endo -79.88 -3.64 12.9 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.307 2.005 . . . . 0.0 112.655 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.902 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -90.79 11.03 23.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.283 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp 54.05 177.42 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.829 0.347 . . . . 0.0 110.978 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.428 ' HG3' ' CD2' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -107.51 -30.74 8.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.845 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.428 ' CD2' ' HG3' ' A' ' 100' ' ' ARG . 13.2 p90 . . . . . 0 C--O 1.248 0.982 0 CA-C-O 118.275 -0.869 . . . . 0.0 110.929 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 22.6 p . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.778 0.323 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.451 ' CB ' ' CD ' ' B' ' 3' ' ' PRO . 0.5 OUTLIER -169.56 -64.1 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.932 179.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.451 ' CD ' ' CB ' ' B' ' 2' ' ' ARG . 70.5 Cg_endo -66.08 -99.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.758 2.306 . . . . 0.0 112.278 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.689 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -162.1 146.0 12.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 111.018 179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.84 -47.73 11.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.027 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.908 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.9 OUTLIER -63.44 -39.13 93.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.247 179.221 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.689 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.6 OUTLIER -52.39 -34.24 47.06 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.705 179.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.42 -39.58 32.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.987 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.591 ' HB2' HD22 ' A' ' 13' ' ' LEU . 2.8 p -58.64 -42.51 88.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.372 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.105 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -67.57 -56.05 14.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.819 -179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.979 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -51.9 -27.23 12.22 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.493 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.564 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.5 m -71.75 -55.67 7.2 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 -179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.942 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -63.68 -28.36 69.84 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.105 HD11 HG22 ' B' ' 10' ' ' ILE . 7.5 mt -70.73 -36.96 67.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.562 0.696 . . . . 0.0 110.615 179.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.54 -33.08 58.57 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.233 -176.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.942 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.7 m -53.23 -38.86 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.58 ' CD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -75.24 -57.75 3.71 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.199 -1.364 . . . . 0.0 110.58 179.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -48.96 -30.38 5.91 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -52.29 65.96 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.101 -178.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.852 ' HB3' HD21 ' B' ' 30' ' ' LEU . 17.4 m-85 -81.04 -47.89 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.767 0.794 . . . . 0.0 109.873 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.528 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.87 -25.08 55.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.632 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.86 158.57 31.36 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.389 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -158.43 92.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.349 . . . . 0.0 110.932 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.74 -49.1 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.793 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.78 -50.34 0.96 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.557 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -156.61 -66.98 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.812 0.339 . . . . 0.0 110.948 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t 59.06 79.14 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.831 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 15.3 m -94.33 -17.54 7.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.579 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.412 HG22 ' O ' ' B' ' 71' ' ' LEU . 16.6 p -139.3 178.77 6.95 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.141 0.496 . . . . 0.0 111.166 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.852 HD21 ' HB3' ' B' ' 20' ' ' TYR . 1.3 tt -125.29 -115.34 0.28 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.951 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.51 ' N ' ' HB2' ' B' ' 71' ' ' LEU . 43.4 t 176.01 129.16 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.444 ' HB3' ' HE2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.7 -35.79 23.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.914 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.733 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.07 -44.2 54.98 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.886 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.463 ' HB3' HD21 ' B' ' 30' ' ' LEU . 0.7 OUTLIER -58.57 -28.78 65.86 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.094 179.68 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -70.38 -28.09 64.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.964 178.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.733 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.51 -58.89 6.07 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.714 0.769 . . . . 0.0 111.057 179.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.968 ' O ' HG22 ' B' ' 41' ' ' THR . 3.2 m -56.13 -44.18 78.93 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.533 -1.212 . . . . 0.0 111.421 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.438 ' HE1' HG21 ' A' ' 6' ' ' THR . 10.2 t80 -57.47 -29.14 64.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.883 0.373 . . . . 0.0 110.899 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.461 ' HA ' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -76.5 -41.34 47.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.692 179.842 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -73.61 -19.49 60.85 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.221 -179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.968 HG22 ' O ' ' B' ' 37' ' ' SER . 0.6 OUTLIER -98.22 -66.93 0.87 Allowed 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -177.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.6 ' H ' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -96.23 -20.92 18.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.423 0.898 . . . . 0.0 113.423 -176.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.588 HD21 HD11 ' A' ' 10' ' ' ILE . 31.6 mt -120.57 45.78 2.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.139 0.495 . . . . 0.0 110.618 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.75 -32.14 35.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.998 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.51 -23.67 51.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.754 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -90.35 -8.52 50.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.18 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.43 ' CG2' ' HG2' ' B' ' 39' ' ' MET . 6.6 p -112.79 -28.4 7.78 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.024 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 mttt -53.79 -79.08 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.907 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.412 ' O ' ' N ' ' B' ' 51' ' ' LYS . 14.1 m-20 -59.23 -55.53 33.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.865 0.364 . . . . 0.0 110.351 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.66 -80.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.526 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' B' ' 49' ' ' ASN . 4.1 ttmt 59.74 25.51 14.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.924 0.392 . . . . 0.0 110.49 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -170.63 106.46 0.42 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.564 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.28 36.72 0.62 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.545 2.163 . . . . 0.0 112.791 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.498 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -137.22 4.97 3.52 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.906 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.9 t -84.66 -63.2 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.946 0.373 . . . . 0.0 111.422 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' ' HG2' ' B' ' 59' ' ' MET . 0.2 OUTLIER -64.46 -50.28 68.09 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -179.076 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.84 -45.2 78.47 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 0.0 OUTLIER -58.62 -25.23 62.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.95 0.405 . . . . 0.0 111.024 -179.784 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 1.069 ' HG3' HD21 ' B' ' 83' ' ' LEU . 9.5 mmm -65.65 -54.62 25.13 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.497 0.665 . . . . 0.0 112.021 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.792 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -73.73 -48.64 30.39 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.436 -178.716 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' B' ' 62' ' ' LYS . 16.8 pttt -66.64 -52.82 40.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.762 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . 0.429 ' N ' ' HG3' ' B' ' 61' ' ' LYS . 0.0 OUTLIER -81.06 5.98 14.95 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.446 179.188 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.812 HD23 ' N ' ' B' ' 64' ' ' ASP . 0.7 OUTLIER -47.23 -27.73 1.63 Allowed 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.376 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.812 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.9 OUTLIER 34.14 83.67 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.313 179.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.542 ' O ' HD12 ' B' ' 65' ' ' LEU . 4.0 pp -134.57 152.4 51.76 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.934 0.397 . . . . 0.0 111.045 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -145.26 89.6 1.96 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.37 -49.98 0.73 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.766 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -174.9 36.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.68 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 69.79 13.74 69.4 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.631 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.43 -174.42 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.933 0.397 . . . . 0.0 111.122 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.585 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.4 OUTLIER -69.66 -140.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.482 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.6 OUTLIER 173.36 169.86 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.933 0.396 . . . . 0.0 111.044 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.498 ' HB2' HG11 ' A' ' 85' ' ' VAL . 2.8 m-85 -59.16 -62.32 1.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.86 179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' O ' ' N ' ' B' ' 78' ' ' ASN . 49.9 tp60 -67.97 -28.75 67.72 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.625 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.623 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -44.54 -40.52 5.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 110.201 179.688 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.462 ' CE1' ' CG2' ' B' ' 16' ' ' VAL . 1.7 t80 -72.05 -54.04 11.05 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.294 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.506 HD21 ' CB ' ' B' ' 13' ' ' LEU . 5.7 mt -54.68 -33.84 61.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.402 0.62 . . . . 0.0 109.516 178.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.468 ' N ' ' O ' ' B' ' 74' ' ' GLN . 1.4 m-20 -74.44 -49.85 20.78 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.33 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.906 ' HG ' ' HB3' ' B' ' 59' ' ' MET . 7.2 mp -65.01 -58.31 6.42 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.732 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.564 ' CD1' HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -65.97 -46.55 87.93 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.107 0 O-C-N 123.386 0.429 . . . . 0.0 111.283 179.524 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.496 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -55.72 -50.47 60.61 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -55.45 -30.03 54.68 Favored Glycine 0 CA--C 1.522 0.514 0 C-N-CA 120.467 -0.873 . . . . 0.0 111.69 177.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 1.069 HD21 ' HG3' ' B' ' 59' ' ' MET . 24.7 mt -66.69 -47.22 73.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.043 0.449 . . . . 0.0 110.177 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.572 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.24 -34.81 64.33 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.689 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.509 HG11 ' HB2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.03 -17.48 9.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.364 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -116.09 16.56 16.0 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.244 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.458 ' N ' ' O ' ' B' ' 83' ' ' LEU . 22.8 t -163.53 -30.92 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.572 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 57.1 t60 -84.48 51.72 2.18 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.831 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 38.62 32.57 0.06 Allowed 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.419 ' HB2' ' HA ' ' B' ' 85' ' ' VAL . 0.4 OUTLIER -94.09 -67.04 0.88 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.889 0.376 . . . . 0.0 110.486 179.645 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -104.15 -36.05 7.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.389 179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.442 HG21 ' CA ' ' B' ' 87' ' ' CYS . 0.0 OUTLIER -57.04 -33.25 42.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.957 179.698 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -15.99 64.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.915 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . 0.429 ' C ' ' HD3' ' B' ' 96' ' ' PRO . . . -136.36 58.86 1.72 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.312 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.89 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -126.91 64.9 61.38 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.443 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 40.6 Cg_exo -58.65 -47.45 18.77 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.706 2.271 . . . . 0.0 112.95 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 99.0 Cg_endo -79.86 -3.67 12.93 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.345 2.03 . . . . 0.0 112.54 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.89 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.0 OUTLIER -90.84 11.03 23.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.221 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp 53.99 177.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.771 0.319 . . . . 0.0 111.058 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . 0.426 ' HG3' ' CD2' ' B' ' 101' ' ' PHE . 0.0 OUTLIER -107.52 -30.77 8.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . 0.426 ' CD2' ' HG3' ' B' ' 100' ' ' ARG . 12.9 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.868 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.798 0.333 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.427 ' N ' ' HD3' ' A' ' 3' ' ' PRO . 9.0 mmp_? 59.07 64.4 3.22 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.997 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.44 ' HB2' ' CB ' ' A' ' 7' ' ' GLU . 34.7 Cg_exo -64.37 -126.93 0.0 OUTLIER 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 123.022 2.482 . . . . 0.0 111.986 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.565 HG23 ' H ' ' A' ' 7' ' ' GLU . 10.1 t -95.45 156.72 16.2 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.67 0.748 . . . . 0.0 111.263 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.9 -48.04 11.24 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.868 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.824 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.9 m -67.11 -34.42 77.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.736 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.565 ' H ' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.91 -45.98 64.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.882 0.373 . . . . 0.0 110.579 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -26.81 66.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.401 178.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.449 ' CB ' ' HB3' ' B' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.1 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.678 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.022 HG12 HD11 ' B' ' 80' ' ' ILE . 1.6 mp -48.9 -56.11 2.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.877 0.37 . . . . 0.0 111.652 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.958 ' HA ' HD12 ' A' ' 14' ' ' ILE . 5.2 mt-10 -51.85 -27.19 11.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.722 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 3.4 m -62.09 -55.9 24.26 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.011 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -76.04 -27.83 57.46 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.018 HD11 HG22 ' A' ' 10' ' ' ILE . 7.2 mt -67.15 -37.3 78.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.489 0.662 . . . . 0.0 111.008 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.92 -32.59 57.48 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.507 -1.224 . . . . 0.0 112.565 -176.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.011 HG22 ' O ' ' A' ' 13' ' ' LEU . 22.1 m -52.02 -38.2 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.482 ' N ' HG23 ' A' ' 16' ' ' VAL . 7.6 t80 -77.4 -58.42 3.29 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 114.18 -1.373 . . . . 0.0 110.244 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.805 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.7 mm-40 -49.12 -25.61 2.25 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.3 -52.74 36.84 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.916 -178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.908 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.1 m-85 -81.6 -39.47 24.45 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.828 0.823 . . . . 0.0 109.894 178.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.558 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -70.6 -27.82 64.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.853 -179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -125.66 123.58 4.95 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.567 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.73 29.17 0.93 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.749 0.309 . . . . 0.0 110.848 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -166.16 31.75 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.917 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.89 -61.17 1.66 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.501 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -79.2 154.59 29.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 82.2 p -162.31 115.26 1.73 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.798 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.422 HG13 ' N ' ' A' ' 29' ' ' THR . 12.2 p -134.43 -41.76 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.48 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.509 HG22 ' HA ' ' A' ' 72' ' ' ASP . 2.5 p -134.93 154.76 51.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.183 0.516 . . . . 0.0 111.176 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.908 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -111.05 -136.39 0.37 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.551 -0.749 . . . . 0.0 109.918 179.754 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.476 ' H ' HD22 ' A' ' 30' ' ' LEU . 6.5 t -168.01 133.84 1.94 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.771 0.32 . . . . 0.0 110.539 179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' CB ' HD11 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -49.86 -39.97 40.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.917 -179.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.739 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -69.17 -46.63 67.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.653 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.424 ' O ' ' CD2' ' A' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.74 65.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.033 0.444 . . . . 0.0 110.287 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.767 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.6 OUTLIER -69.31 -29.4 67.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.872 -0.603 . . . . 0.0 110.111 179.012 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.739 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -51.73 -59.06 4.73 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.636 0.731 . . . . 0.0 111.297 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.24 -47.23 81.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.57 -1.195 . . . . 0.0 111.386 -178.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 42' ' ' GLU . 10.8 t80 -57.73 -51.07 71.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.673 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.439 ' HE3' ' HB2' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -63.43 -30.78 71.85 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.551 179.76 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.75 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 89.3 m-20 -73.53 -19.84 60.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.881 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -118.97 -80.41 0.61 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.107 0.479 . . . . 0.0 111.501 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.453 ' HB2' ' CE1' ' A' ' 38' ' ' PHE . 2.2 mm-40 -46.0 -38.58 7.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.027 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.84 HD21 HD11 ' B' ' 10' ' ' ILE . 23.3 mt -130.69 50.8 2.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.937 0.399 . . . . 0.0 110.679 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.75 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -80.78 -35.19 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.099 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.417 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . . . -56.98 -25.06 57.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.162 179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.454 ' CE2' ' NE2' ' A' ' 88' ' ' HIS . 43.6 m-85 -91.97 15.09 13.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.148 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.423 HG21 ' CG ' ' A' ' 39' ' ' MET . 26.3 p -139.12 -42.65 0.46 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.492 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 45' ' ' ALA . 0.7 OUTLIER -59.91 94.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.973 179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 58.75 85.76 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.66 134.82 53.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.851 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.45 -27.03 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.946 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.566 ' HB3' HG23 ' A' ' 55' ' ' VAL . 2.3 m-20 -100.23 103.96 26.5 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -81.2 5.42 6.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.621 2.214 . . . . 0.0 112.874 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.74 -11.97 29.31 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.85 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.617 HG22 ' O ' ' A' ' 86' ' ' ALA . 40.8 t -52.92 -59.86 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.766 0.317 . . . . 0.0 111.404 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.826 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.2 OUTLIER -67.81 -51.68 45.85 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.152 0.501 . . . . 0.0 110.488 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.826 ' N ' HD23 ' A' ' 56' ' ' LEU . 1.7 t0 -55.11 -26.83 40.87 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.905 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.588 HH21 ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -61.97 -47.26 85.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.682 179.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.842 ' CE ' HD21 ' A' ' 83' ' ' LEU . 5.1 ptp -69.31 -53.78 17.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.036 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.642 ' HE3' ' HG2' ' A' ' 59' ' ' MET . 2.0 mtm -59.96 -26.27 65.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.898 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -61.11 -59.88 4.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.647 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.27 -6.05 57.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.732 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.899 ' HB2' HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -81.26 6.01 15.4 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -179.627 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.08 84.89 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.849 0.357 . . . . 0.0 110.748 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.701 HD11 ' OE1' ' A' ' 75' ' ' GLU . 2.2 mm? -73.72 116.61 14.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.896 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.45 -43.0 3.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.775 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.93 161.15 13.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.981 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 76.3 -53.35 0.6 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.686 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.83 23.43 23.14 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.204 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.507 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.1 mm-40 -155.95 167.79 29.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.699 0.285 . . . . 0.0 111.401 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.698 ' HB2' ' C ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -64.49 -132.79 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.663 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.509 ' HA ' HG22 ' A' ' 29' ' ' THR . 2.3 t0 176.71 -171.37 0.08 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.81 0.732 . . . . 0.0 111.444 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.801 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.4 p90 -77.6 -54.87 5.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.489 -179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.478 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.5 tp60 -77.63 -30.36 52.19 Favored 'General case' 0 CA--C 1.515 -0.37 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.326 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.726 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -44.83 -33.1 1.8 Allowed 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.594 ' HD2' HD12 ' A' ' 30' ' ' LEU . 2.0 t80 -80.44 -54.4 5.73 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.847 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' B' ' 77' ' ' LEU . 6.9 mt -55.98 -33.37 64.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.408 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.14 -39.68 54.49 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.135 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.899 HD11 ' HB2' ' A' ' 63' ' ' LEU . 1.7 mp -64.56 -57.77 8.22 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.748 179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.038 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.82 -43.71 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.224 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.139 179.427 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 77' ' ' LEU . . . -52.71 -50.31 49.93 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.005 179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.49 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -51.71 -35.52 38.57 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.359 -0.924 . . . . 0.0 111.427 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.842 HD21 ' CE ' ' A' ' 59' ' ' MET . 8.4 mt -62.19 -46.07 90.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 120.921 0.391 . . . . 0.0 110.098 178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.32 -35.42 65.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.375 0.607 . . . . 0.0 110.849 179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.812 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -81.09 -17.15 12.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.115 -179.8 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.668 ' HA ' HG13 ' A' ' 92' ' ' VAL . . . -117.35 15.72 14.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.552 -179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.3 OUTLIER -160.99 -27.43 0.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 -179.443 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.525 ' HB2' ' O ' ' A' ' 84' ' ' ALA . 14.2 m-70 -93.79 27.56 2.68 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.611 -0.436 . . . . 0.0 112.159 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.783 ' HA ' HG23 ' A' ' 92' ' ' VAL . 1.4 mp0 59.34 16.51 5.11 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -72.94 -50.7 21.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.949 0.404 . . . . 0.0 109.95 179.334 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.715 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -113.03 -38.75 4.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.779 178.775 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.783 HG23 ' HA ' ' A' ' 89' ' ' GLU . 1.6 m -58.59 -25.45 28.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.087 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -81.36 -2.39 49.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.365 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.83 -31.73 64.99 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.78 0.324 . . . . 0.0 111.175 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.846 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -141.64 60.07 10.92 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.314 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.477 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 35.0 Cg_exo -59.41 -46.64 20.17 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.68 2.253 . . . . 0.0 112.985 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.441 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 86.4 Cg_endo -82.62 -17.78 7.16 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.511 2.14 . . . . 0.0 112.918 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.846 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 1.2 tt0 -50.14 109.59 0.31 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.904 0.383 . . . . 0.0 111.128 -179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -59.81 -176.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.43 75.0 1.38 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.955 -179.993 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.766 0.317 . . . . 0.0 111.274 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.415 ' N ' ' HD3' ' B' ' 3' ' ' PRO . 9.1 mmp_? 59.05 64.37 3.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.994 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.444 ' HB2' ' CB ' ' B' ' 7' ' ' GLU . 35.1 Cg_exo -64.35 -126.85 0.0 OUTLIER 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.024 2.483 . . . . 0.0 112.076 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.571 HG23 ' H ' ' B' ' 7' ' ' GLU . 10.1 t -95.55 156.75 16.19 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.625 0.726 . . . . 0.0 111.328 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -44.88 -48.14 11.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.801 -179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.801 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.8 m -67.06 -34.33 77.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.762 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.571 ' H ' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.99 -45.95 64.68 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.867 0.365 . . . . 0.0 110.534 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -26.8 66.27 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.36 179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.448 ' HA ' ' HB3' ' A' ' 12' ' ' SER . 59.2 m -70.77 -58.96 3.09 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.655 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.055 HG22 HD11 ' B' ' 14' ' ' ILE . 1.6 mp -48.94 -56.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.543 -179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 5.3 mt-10 -51.77 -27.27 11.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.7 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 3.3 m -62.07 -55.83 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 1.017 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -76.17 -27.75 57.08 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -178.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.055 HD11 HG22 ' B' ' 10' ' ' ILE . 7.1 mt -67.19 -37.27 78.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 O-C-N 121.558 -0.714 . . . . 0.0 110.964 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.99 -32.63 57.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.469 -1.241 . . . . 0.0 112.539 -176.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 1.017 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.0 m -52.05 -38.17 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.465 ' N ' HG23 ' B' ' 16' ' ' VAL . 7.5 t80 -77.46 -58.38 3.3 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.155 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.7 mm-40 -49.17 -25.65 2.33 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.13 -52.83 36.83 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.891 -178.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.929 ' HB3' HD21 ' B' ' 30' ' ' LEU . 8.1 m-85 -81.63 -39.44 24.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.808 0.813 . . . . 0.0 109.864 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.569 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -70.64 -27.83 64.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.118 -1.401 . . . . 0.0 111.816 -179.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -125.61 123.51 4.93 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.629 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.68 29.19 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.862 0.363 . . . . 0.0 110.891 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -166.12 31.76 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.9 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.8 -61.07 1.69 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.537 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -79.2 154.53 29.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.908 0.385 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 81.0 p -162.25 115.19 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.812 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.42 HG13 ' N ' ' B' ' 29' ' ' THR . 12.0 p -134.52 -41.7 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.472 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.525 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 2.4 p -135.05 154.85 51.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.222 0.535 . . . . 0.0 111.121 -179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.929 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.2 OUTLIER -111.02 -136.37 0.36 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.015 179.817 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.474 ' H ' HD22 ' B' ' 30' ' ' LEU . 6.5 t -167.98 133.82 1.95 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.756 0.312 . . . . 0.0 110.577 179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.451 ' CB ' HD11 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -49.81 -39.97 40.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.96 -179.712 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -69.2 -46.65 66.93 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.58 179.871 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.419 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.1 mt-10 -57.76 -29.76 65.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.953 0.406 . . . . 0.0 110.195 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.763 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.6 OUTLIER -69.25 -29.51 67.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.069 179.07 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.741 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.61 -59.02 4.74 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.664 0.745 . . . . 0.0 111.371 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.42 -47.16 82.49 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.346 -178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' B' ' 42' ' ' GLU . 10.9 t80 -57.76 -51.07 71.07 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.65 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.456 ' HE3' ' HB2' ' B' ' 43' ' ' LEU . 0.0 OUTLIER -63.29 -30.93 71.98 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.547 179.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.735 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 89.3 m-20 -73.48 -19.8 60.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.843 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 p -119.02 -80.38 0.61 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 0.0 111.491 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.444 ' HB2' ' CE1' ' B' ' 38' ' ' PHE . 2.1 mm-40 -46.03 -38.56 8.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.031 -179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 10' ' ' ILE . 23.4 mt -130.77 50.81 2.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.982 0.42 . . . . 0.0 110.662 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -80.77 -35.21 33.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.068 -179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' B' ' 48' ' ' LYS . . . -57.05 -24.99 57.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.175 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CE2' ' NE2' ' B' ' 88' ' ' HIS . 43.9 m-85 -91.87 14.96 14.04 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.133 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.419 HG21 ' CG ' ' B' ' 39' ' ' MET . 26.3 p -139.01 -42.77 0.47 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.95 0.405 . . . . 0.0 110.445 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' B' ' 45' ' ' ALA . 0.7 OUTLIER -59.8 94.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.032 179.925 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.73 85.78 0.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.85 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.67 134.85 53.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.931 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -27.03 63.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.946 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.569 ' HB3' HG23 ' B' ' 55' ' ' VAL . 2.3 m-20 -100.24 103.96 26.54 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.896 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.19 5.46 6.23 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.547 2.164 . . . . 0.0 112.904 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.76 -11.88 29.47 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.909 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.623 HG22 ' O ' ' B' ' 86' ' ' ALA . 41.0 t -52.97 -59.89 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.741 0.305 . . . . 0.0 111.314 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.835 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.2 OUTLIER -67.77 -51.71 45.72 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.216 0.532 . . . . 0.0 110.536 179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.835 ' N ' HD23 ' B' ' 56' ' ' LEU . 1.7 t0 -55.09 -26.87 40.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.881 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.59 HH21 ' HB2' ' B' ' 86' ' ' ALA . 0.2 OUTLIER -61.91 -47.19 86.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.708 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.854 ' CE ' HD21 ' B' ' 83' ' ' LEU . 5.1 ptp -69.44 -53.81 17.48 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.908 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.655 ' HE3' ' HG2' ' B' ' 59' ' ' MET . 2.0 mtm -59.95 -26.3 65.87 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.776 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 20.2 mttm -61.1 -59.95 4.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.618 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.25 -5.94 57.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.903 ' HB2' HD11 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -81.34 6.01 15.63 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.15 84.94 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.926 0.393 . . . . 0.0 110.742 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.692 HD11 ' OE1' ' B' ' 75' ' ' GLU . 2.2 mm? -73.67 116.62 14.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.47 -42.88 3.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.821 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.15 161.23 13.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.907 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 76.2 -53.32 0.61 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.684 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.85 23.5 22.89 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.144 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.525 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.1 mm-40 -156.03 167.77 29.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.762 0.315 . . . . 0.0 111.386 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.702 ' HB2' ' C ' ' B' ' 30' ' ' LEU . 0.1 OUTLIER -64.48 -132.81 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.489 ' HA ' HG22 ' B' ' 29' ' ' THR . 2.3 t0 176.67 -171.37 0.08 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.798 0.727 . . . . 0.0 111.409 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.812 ' CG ' HG11 ' A' ' 85' ' ' VAL . 44.4 p90 -77.65 -54.96 5.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.433 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.468 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.5 tp60 -77.57 -30.38 52.54 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.319 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.72 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.1 OUTLIER -44.79 -33.17 1.8 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.858 0.361 . . . . 0.0 110.155 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.595 ' HD2' HD12 ' B' ' 30' ' ' LEU . 2.0 t80 -80.32 -54.42 5.74 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.882 178.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.748 HD22 HD22 ' A' ' 77' ' ' LEU . 6.9 mt -55.95 -33.37 64.7 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.412 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.2 OUTLIER -76.12 -39.8 54.33 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 178.101 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.903 HD11 ' HB2' ' B' ' 63' ' ' LEU . 1.7 mp -64.36 -57.92 7.97 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.773 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 1.022 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.75 -43.77 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.245 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.137 179.429 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' LEU . . . -52.69 -50.27 49.97 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.316 -0.945 . . . . 0.0 111.068 179.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.491 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.8 -35.45 39.06 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.383 -0.913 . . . . 0.0 111.394 178.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.854 HD21 ' CE ' ' B' ' 59' ' ' MET . 8.6 mt -62.29 -46.06 90.48 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.896 0.379 . . . . 0.0 110.048 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.52 ' O ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.42 -35.3 65.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.329 0.585 . . . . 0.0 110.812 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.801 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -81.08 -17.25 12.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.159 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.683 ' HA ' HG13 ' B' ' 92' ' ' VAL . . . -117.31 15.72 14.82 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.534 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.411 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.3 OUTLIER -160.98 -27.37 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -179.424 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.52 ' HB2' ' O ' ' B' ' 84' ' ' ALA . 14.1 m-70 -93.92 27.67 2.69 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.547 -0.461 . . . . 0.0 112.121 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.763 ' HA ' HG23 ' B' ' 92' ' ' VAL . 1.4 mp0 59.31 16.52 5.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 178.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.431 ' CB ' ' HA ' ' B' ' 85' ' ' VAL . 0.2 OUTLIER -72.88 -50.75 21.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.971 0.415 . . . . 0.0 109.931 179.359 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.712 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -113.06 -38.69 4.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.789 178.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.763 HG23 ' HA ' ' B' ' 89' ' ' GLU . 1.6 m -58.61 -25.46 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.156 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -81.33 -2.44 49.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.348 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.85 -31.73 64.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.801 0.334 . . . . 0.0 111.199 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.824 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -141.67 60.12 10.96 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.282 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.479 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 35.3 Cg_exo -59.5 -46.69 19.67 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.623 2.215 . . . . 0.0 112.904 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 86.8 Cg_endo -82.54 -17.77 7.26 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.478 2.119 . . . . 0.0 112.99 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.824 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 1.2 tt0 -50.09 109.56 0.31 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.865 0.364 . . . . 0.0 111.131 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -59.71 -176.66 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.02 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.53 75.07 1.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.851 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.862 179.958 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.856 0.36 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.4 OUTLIER -179.48 -51.4 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.058 179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' CB ' ' A' ' 2' ' ' ARG . 17.2 Cg_exo -71.88 -134.91 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.15 2.567 . . . . 0.0 111.85 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.473 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -104.58 152.98 21.76 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.517 0.675 . . . . 0.0 111.189 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.82 -49.06 10.97 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.024 . . . . 0.0 111.421 -179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.939 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.2 OUTLIER -64.25 -41.56 96.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.093 0.473 . . . . 0.0 110.194 179.207 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.473 ' HB2' HG23 ' A' ' 4' ' ' THR . 1.0 OUTLIER -51.44 -31.61 23.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -28.31 41.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.928 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.595 ' HB2' HD22 ' B' ' 13' ' ' LEU . 4.3 p -73.95 -40.66 62.89 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.391 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.077 HG22 HD11 ' A' ' 14' ' ' ILE . 2.5 mp -66.92 -56.14 15.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.902 -179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.939 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.4 OUTLIER -52.18 -27.33 14.13 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.428 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.581 ' O ' HG13 ' A' ' 16' ' ' VAL . 5.9 m -72.19 -56.03 6.24 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -178.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.837 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.7 mm? -64.9 -27.5 68.9 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.077 HD11 HG22 ' A' ' 10' ' ' ILE . 12.8 mt -69.06 -37.35 76.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.829 0 CA-C-O 121.491 0.662 . . . . 0.0 110.611 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.615 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . . . -76.49 -39.69 52.41 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 114.027 -1.442 . . . . 0.0 112.402 -176.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 13' ' ' LEU . 20.2 m -50.96 -33.89 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 1.3 t80 -80.55 -59.01 2.85 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 114.222 -1.354 . . . . 0.0 113.249 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -70.67 -24.73 62.74 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.002 0.741 . . . . 0.0 113.002 -177.4 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.43 -51.61 62.08 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.146 -0.622 . . . . 0.0 109.817 -179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.565 ' HB3' ' CE2' ' A' ' 38' ' ' PHE . 7.1 m-85 -80.83 -40.89 24.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.889 0.852 . . . . 0.0 109.564 177.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -62.58 -12.97 26.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.155 -1.384 . . . . 0.0 112.285 -179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -70.2 65.36 0.73 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.463 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -81.8 -51.81 7.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.867 0.365 . . . . 0.0 110.92 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.73 174.65 10.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.86 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.69 -27.51 56.78 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.522 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -101.37 32.56 3.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 110.936 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -148.08 140.11 24.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.883 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.0 p -140.06 63.86 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.106 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.543 HG22 ' HA ' ' A' ' 72' ' ' ASP . 9.3 p -148.23 -179.38 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.857 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.692 ' C ' ' HB2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -138.97 -161.12 1.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.953 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.622 ' H ' HD13 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -136.66 132.37 34.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.691 0.281 . . . . 0.0 110.398 178.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -40.64 41.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 110.512 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.713 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.17 -41.45 61.46 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.534 179.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.462 ' O ' ' CD2' ' A' ' 38' ' ' PHE . 2.0 mt-10 -58.91 -32.36 69.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.079 0.466 . . . . 0.0 109.782 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.719 ' HD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -69.09 -26.88 65.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.385 179.295 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.713 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -55.61 -59.2 5.18 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.613 0.721 . . . . 0.0 111.191 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.452 ' O ' HG22 ' A' ' 41' ' ' THR . 14.6 m -60.16 -45.14 94.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.204 -178.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.63 ' HE2' HD11 ' A' ' 30' ' ' LEU . 2.6 m-30 -57.8 -26.71 62.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.608 ' HG2' HG21 ' A' ' 47' ' ' THR . 2.7 ttm -78.24 -56.12 4.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.89 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 66.1 m-80 -57.55 -19.69 27.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.025 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.959 HG23 ' HG2' ' A' ' 42' ' ' GLU . 10.8 t -96.68 -30.76 13.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.959 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.5 OUTLIER -127.46 -37.5 2.0 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -177.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' B' ' 10' ' ' ILE . 7.9 mt -106.85 35.25 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.24 0.543 . . . . 0.0 110.256 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.413 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -77.11 -28.61 54.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.745 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.46 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . . . -54.15 -27.46 33.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.74 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.42 ' CZ ' ' CD2' ' A' ' 88' ' ' HIS . 3.5 m-85 -86.46 -28.23 23.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.591 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.608 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.7 p -83.74 -33.36 25.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.212 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' A' ' 45' ' ' ALA . 1.6 pttt -72.91 -31.82 64.9 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.858 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -115.87 44.53 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.577 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -60.44 -61.2 2.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.271 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 59.54 25.59 14.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.42 -179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 53' ' ' PRO . 0.1 OUTLIER -174.6 118.65 0.34 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.565 -179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 3.0 Cg_exo -75.13 12.4 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.68 2.254 . . . . 0.0 113.062 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.23 7.55 23.05 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.845 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' ' 86' ' ' ALA . 53.3 t -84.08 -62.74 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.871 0.367 . . . . 0.0 111.056 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 56' ' ' LEU . 6.6 tt -66.82 -51.96 49.41 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.664 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -26.85 47.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.036 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.9 -52.95 63.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.915 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.879 ' CE ' HD21 ' A' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.54 55.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.915 0.388 . . . . 0.0 111.002 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.847 ' HE3' HD21 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -54.71 -37.93 66.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.518 -179.343 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -78.03 -31.07 50.24 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.867 0.365 . . . . 0.0 110.622 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.33 -23.11 40.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.991 -179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.887 ' HB3' HD11 ' A' ' 79' ' ' LEU . 2.2 pp -81.37 7.14 12.36 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -59.6 68.34 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.018 0.437 . . . . 0.0 110.018 179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.76 HD23 ' O ' ' A' ' 63' ' ' LEU . 0.2 OUTLIER -76.21 159.84 30.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.163 -179.144 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 -94.64 20.74 8.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.391 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.82 -31.75 15.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 0.0 110.639 179.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 49.89 28.01 2.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.94 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -123.43 -60.67 0.19 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.738 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.537 HE21 ' HA ' ' A' ' 70' ' ' GLN . 1.7 mm-40 -151.34 -177.7 6.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.753 0.311 . . . . 0.0 111.423 -179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -64.6 -133.6 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.543 ' HA ' HG22 ' A' ' 29' ' ' THR . 1.7 t0 175.46 -169.51 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 118.801 0.728 . . . . 0.0 111.49 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.831 ' CD2' HG21 ' B' ' 85' ' ' VAL . 38.4 p90 -73.69 -58.86 3.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.469 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.482 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -80.05 -25.49 40.11 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.175 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.879 ' HB3' HD13 ' A' ' 71' ' ' LEU . 0.2 OUTLIER -44.88 -32.69 1.68 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 16' ' ' VAL . 1.1 t80 -80.12 -54.07 6.11 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.572 178.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' B' ' 77' ' ' LEU . 7.1 mt -56.97 -33.52 67.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.979 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.474 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -75.09 -42.01 57.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 63' ' ' LEU . 1.2 mp -65.92 -57.3 8.17 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.132 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.888 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -72.13 -44.5 64.99 Favored 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.948 179.316 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.73 -50.24 50.36 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.145 -1.026 . . . . 0.0 110.731 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.63 -40.1 47.28 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.362 -0.923 . . . . 0.0 111.551 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.879 HD21 ' CE ' ' A' ' 59' ' ' MET . 6.9 mt -59.17 -46.36 88.6 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 120.892 0.377 . . . . 0.0 110.353 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.725 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.5 -33.65 63.92 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 111.291 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.818 HG21 ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -82.65 -17.07 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.282 -179.476 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.828 ' HB1' HG22 ' A' ' 55' ' ' VAL . . . -116.78 11.86 14.65 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.878 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.433 ' N ' HG22 ' A' ' 92' ' ' VAL . 18.6 t -152.75 -39.51 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.0 OUTLIER -89.82 -85.27 0.21 Allowed 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.82 -179.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -133.15 177.19 7.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.734 0.302 . . . . 0.0 111.079 -179.395 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 70.7 m 60.9 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.631 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 76.25 -49.45 0.59 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.247 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.433 HG22 ' N ' ' A' ' 87' ' ' CYS . 35.9 t -43.42 -53.6 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 121.078 0.466 . . . . 0.0 111.575 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.33 26.36 2.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.097 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -158.85 27.52 0.22 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.052 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.726 ' HB3' ' CD ' ' A' ' 96' ' ' PRO . . . -90.42 -68.97 0.1 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.388 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.726 ' CD ' ' HB3' ' A' ' 95' ' ' ALA . 5.8 Cg_endo -46.98 -35.84 19.27 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 122.762 2.308 . . . . 0.0 113.868 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.587 ' HD3' ' HG2' ' A' ' 96' ' ' PRO . 5.5 Cg_exo -74.91 -27.59 10.07 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.091 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.66 -51.52 69.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.936 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.43 128.43 44.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -77.13 124.33 27.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.926 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.747 0.308 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.413 ' N ' ' CD ' ' B' ' 3' ' ' PRO . 0.4 OUTLIER -179.45 -51.46 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' B' ' 2' ' ' ARG . 17.2 Cg_exo -71.78 -134.95 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.451 0 C-N-CA 123.192 2.595 . . . . 0.0 111.924 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.461 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -104.55 153.05 21.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.572 0.701 . . . . 0.0 111.194 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -44.85 -49.06 11.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.415 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.934 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.2 OUTLIER -64.22 -41.67 96.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 110.128 179.177 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 4' ' ' THR . 1.0 OUTLIER -51.47 -31.44 23.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.695 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.66 -28.31 40.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.846 179.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.588 ' HB2' HD22 ' A' ' 13' ' ' LEU . 4.3 p -73.95 -40.64 62.91 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.421 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.137 HG22 HD11 ' B' ' 14' ' ' ILE . 2.5 mp -66.77 -56.31 14.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.895 -179.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.943 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.4 OUTLIER -52.13 -27.34 13.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.571 ' O ' HG13 ' B' ' 16' ' ' VAL . 5.9 m -72.12 -56.11 6.15 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.83 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -64.75 -27.69 69.07 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.137 HD11 HG22 ' B' ' 10' ' ' ILE . 13.0 mt -68.99 -37.42 77.2 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.78 0 CA-C-O 121.539 0.685 . . . . 0.0 110.608 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . 0.615 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . . . -76.42 -39.66 52.92 Favored 'General case' 0 N--CA 1.437 -1.122 0 CA-C-N 113.962 -1.472 . . . . 0.0 112.442 -176.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.83 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.2 m -50.91 -33.97 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.509 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 1.3 t80 -80.5 -59.06 2.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 114.207 -1.36 . . . . 0.0 113.211 -178.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -70.7 -24.73 62.72 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -177.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -53.38 -51.61 61.97 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.143 -0.623 . . . . 0.0 109.88 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.558 ' HB3' ' CE2' ' B' ' 38' ' ' PHE . 7.1 m-85 -80.78 -40.95 24.23 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.842 0.829 . . . . 0.0 109.564 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.902 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -62.58 -12.94 25.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.158 -1.383 . . . . 0.0 112.327 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -70.2 65.3 0.73 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.495 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -81.67 -51.87 7.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.835 0.35 . . . . 0.0 110.885 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -140.75 174.55 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.62 -27.61 56.73 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.474 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -101.35 32.51 3.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.836 0.35 . . . . 0.0 110.9 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -148.01 140.16 24.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.834 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.58 ' O ' HG13 ' B' ' 28' ' ' VAL . 10.9 p -140.13 63.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.127 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.525 HG22 ' HA ' ' B' ' 72' ' ' ASP . 9.5 p -148.18 -179.42 6.92 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.906 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.688 ' C ' ' HB2' ' B' ' 71' ' ' LEU . 0.1 OUTLIER -138.95 -161.07 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.019 179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.625 ' H ' HD13 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -136.68 132.32 34.78 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.783 0.325 . . . . 0.0 110.359 178.809 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.65 -40.71 40.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.951 0.405 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.715 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.06 -41.53 61.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.538 179.415 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.46 ' O ' ' CD2' ' B' ' 38' ' ' PHE . 2.0 mt-10 -58.96 -32.36 69.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 109.786 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.705 ' HD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -69.07 -26.81 65.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.446 179.237 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.715 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.4 mm? -55.6 -59.26 5.09 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.455 ' O ' HG22 ' B' ' 41' ' ' THR . 14.6 m -60.04 -45.19 93.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.6 -1.182 . . . . 0.0 111.206 -178.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.638 ' HE2' HD11 ' B' ' 30' ' ' LEU . 2.5 m-30 -57.8 -26.75 62.37 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.973 0.416 . . . . 0.0 110.729 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.619 ' HG2' HG21 ' B' ' 47' ' ' THR . 2.7 ttm -78.22 -56.15 4.69 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.916 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 65.8 m-80 -57.58 -19.61 26.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 112.071 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.978 HG23 ' HG2' ' B' ' 42' ' ' GLU . 10.7 t -96.73 -30.81 13.0 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.978 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.5 OUTLIER -127.38 -37.46 2.02 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 10' ' ' ILE . 7.9 mt -106.93 35.41 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.268 0.556 . . . . 0.0 110.234 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -77.18 -28.6 54.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.777 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . 0.46 ' HA ' ' HG2' ' B' ' 48' ' ' LYS . . . -54.11 -27.5 33.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.76 179.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.423 ' CZ ' ' CD2' ' B' ' 88' ' ' HIS . 3.5 m-85 -86.41 -28.31 23.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.659 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.619 HG21 ' HG2' ' B' ' 39' ' ' MET . 29.7 p -83.77 -33.35 25.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.142 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.46 ' HG2' ' HA ' ' B' ' 45' ' ' ALA . 1.5 pttt -73.02 -31.71 64.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -115.91 44.51 1.91 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 0.0 110.575 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.406 ' HG2' ' HA ' ' B' ' 47' ' ' THR . 1.5 mm-40 -60.39 -61.13 2.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.284 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 59.35 25.76 14.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.483 -179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.465 ' HA ' ' HD3' ' B' ' 53' ' ' PRO . 0.1 OUTLIER -174.61 118.65 0.34 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.606 -179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' B' ' 52' ' ' ASP . 3.0 Cg_exo -75.08 12.26 1.28 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.757 2.304 . . . . 0.0 113.076 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.16 7.61 23.17 Favored Glycine 0 C--N 1.333 0.374 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.938 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.827 HG22 ' HB1' ' B' ' 86' ' ' ALA . 53.7 t -84.09 -62.81 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.881 0.372 . . . . 0.0 111.039 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.676 HD23 ' C ' ' B' ' 56' ' ' LEU . 6.6 tt -66.72 -51.98 49.74 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.662 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.78 -26.82 47.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.069 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -58.83 -52.94 63.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.978 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.906 ' HE2' HD21 ' B' ' 83' ' ' LEU . 1.9 ptp -55.49 -53.52 55.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.027 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.848 ' HE3' HD21 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -54.77 -37.81 66.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.567 -179.373 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -78.12 -30.92 49.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.96 0.409 . . . . 0.0 110.67 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.47 -22.98 40.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.978 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.885 ' HB3' HD11 ' B' ' 79' ' ' LEU . 2.2 pp -81.42 7.23 12.29 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -59.55 68.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.001 0.429 . . . . 0.0 110.044 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.755 HD23 ' O ' ' B' ' 63' ' ' LEU . 0.2 OUTLIER -76.21 159.85 30.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.094 -179.069 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 31.7 m-20 -94.63 20.83 8.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.42 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -91.89 -31.77 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 0.0 110.648 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 49.74 28.15 2.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.965 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -123.52 -60.68 0.19 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.652 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.539 ' HA ' HE21 ' B' ' 70' ' ' GLN . 1.7 mm-40 -151.39 -177.81 6.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.683 0.278 . . . . 0.0 111.407 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.861 HD13 ' HB3' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -64.46 -133.62 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.554 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.525 ' HA ' HG22 ' B' ' 29' ' ' THR . 1.7 t0 175.43 -169.55 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 118.805 0.73 . . . . 0.0 111.458 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' HG21 ' A' ' 85' ' ' VAL . 38.6 p90 -73.61 -58.88 3.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.509 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.485 HE22 ' HB2' ' B' ' 78' ' ' ASN . 0.2 OUTLIER -80.06 -25.5 40.06 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.104 179.408 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.861 ' HB3' HD13 ' B' ' 71' ' ' LEU . 0.2 OUTLIER -44.93 -32.63 1.68 Allowed 'General case' 0 CA--C 1.522 -0.115 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.438 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.565 ' CD1' HG23 ' B' ' 16' ' ' VAL . 1.1 t80 -80.2 -54.01 6.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 114.937 -1.028 . . . . 0.0 109.555 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 1.012 HD22 HD22 ' A' ' 77' ' ' LEU . 7.1 mt -56.97 -33.63 67.27 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.902 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.485 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -74.95 -42.07 58.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.257 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.885 HD11 ' HB3' ' B' ' 63' ' ' LEU . 1.2 mp -65.95 -57.2 8.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.129 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.896 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -72.21 -44.57 64.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.923 179.353 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.436 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.6 -50.3 49.29 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.17 -1.014 . . . . 0.0 110.761 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.561 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.63 -40.07 47.23 Favored Glycine 0 CA--C 1.521 0.436 0 C-N-CA 120.231 -0.985 . . . . 0.0 111.618 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.906 HD21 ' HE2' ' B' ' 59' ' ' MET . 7.0 mt -59.16 -46.39 88.5 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.828 0.347 . . . . 0.0 110.264 178.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.717 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.44 -33.76 63.89 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.23 0.538 . . . . 0.0 111.209 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.831 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -82.64 -17.1 11.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.235 -179.351 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' B' ' 55' ' ' VAL . . . -116.85 11.97 14.62 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.863 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.435 ' N ' HG22 ' B' ' 92' ' ' VAL . 18.7 t -152.78 -39.46 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.675 -0.41 . . . . 0.0 112.103 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.492 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.0 OUTLIER -89.8 -85.24 0.21 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.262 -0.575 . . . . 0.0 111.856 -179.196 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' B' ' 85' ' ' VAL . 0.1 OUTLIER -133.04 177.22 7.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.749 0.309 . . . . 0.0 111.079 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.405 ' O ' ' HB2' ' B' ' 91' ' ' PHE . 70.5 m 60.87 113.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.655 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' B' ' 90' ' ' SER . 0.1 OUTLIER 76.19 -49.48 0.59 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.226 -179.739 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.435 HG22 ' N ' ' B' ' 87' ' ' CYS . 36.0 t -43.38 -53.54 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.32 26.27 3.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.171 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -158.84 27.58 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.086 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.725 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . . . -90.46 -68.89 0.1 Allowed Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.421 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.725 ' CD ' ' HB3' ' B' ' 95' ' ' ALA . 5.8 Cg_endo -46.96 -35.9 19.35 Favored 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.785 2.323 . . . . 0.0 113.766 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.592 ' HD3' ' HG2' ' B' ' 96' ' ' PRO . 5.6 Cg_exo -74.93 -27.61 10.01 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.27 1.98 . . . . 0.0 111.985 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.67 -51.54 69.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.992 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.36 128.44 44.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.96 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 19.2 ttt180 -77.07 124.37 27.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.888 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.255 -0.878 . . . . 0.0 110.919 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.8 m . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.744 0.307 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.429 ' CB ' ' HG3' ' A' ' 7' ' ' GLU . 1.1 mpt_? 58.13 105.35 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.955 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -80.89 16.79 1.54 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.256 2.637 . . . . 0.0 114.244 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.723 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -54.42 144.28 21.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.566 . . . . 0.0 111.03 -179.35 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.43 -44.24 8.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.321 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.863 ' O ' HD12 ' A' ' 10' ' ' ILE . 19.3 m -71.63 -38.18 70.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.363 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.7 OUTLIER -52.49 -53.33 47.17 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 120.969 0.414 . . . . 0.0 110.445 179.772 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.08 -26.65 62.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.584 178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.573 ' HB3' HD22 ' B' ' 13' ' ' LEU . 74.2 m -74.67 -54.42 7.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.569 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' A' ' 14' ' ' ILE . 2.2 mp -54.7 -56.5 10.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.847 0.356 . . . . 0.0 111.574 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.951 ' HA ' HD12 ' A' ' 14' ' ' ILE . 1.8 mt-10 -52.32 -27.46 15.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.847 -179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.624 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.5 OUTLIER -62.88 -55.72 23.59 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.196 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.979 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.1 mm? -74.79 -27.83 60.47 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' A' ' 10' ' ' ILE . 6.6 mt -67.2 -35.93 75.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 O-C-N 121.648 -0.657 . . . . 0.0 110.925 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -78.94 -32.7 45.6 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.615 -1.175 . . . . 0.0 112.455 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.979 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.2 m -52.67 -35.83 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 176.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.561 ' HB2' ' CG ' ' A' ' 76' ' ' PHE . 3.1 t80 -78.02 -59.01 2.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.032 -1.44 . . . . 0.0 110.634 179.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.773 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 3.8 mm-40 -49.61 -45.69 48.38 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -47.91 -51.58 22.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.646 -178.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.517 ' HB3' HD21 ' A' ' 30' ' ' LEU . 3.4 m-85 -81.17 -31.89 33.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.672 0.749 . . . . 0.0 110.289 178.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.478 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -86.72 20.13 2.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.0 -179.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -158.11 107.02 0.3 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.303 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.73 -49.99 0.59 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 111.031 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -160.92 153.12 20.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.93 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.79 -92.19 0.53 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.577 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -109.55 169.4 8.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.821 0.343 . . . . 0.0 110.995 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 66.6 m -161.43 57.02 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.759 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m -116.3 -24.17 3.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.641 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.49 HG22 ' HA ' ' A' ' 72' ' ' ASP . 3.3 p -140.69 153.13 45.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.137 0.494 . . . . 0.0 111.536 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.663 HD12 ' HE2' ' A' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.17 0.51 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.956 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.502 ' H ' HD13 ' A' ' 30' ' ' LEU . 14.0 t -145.25 138.05 26.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.758 0.314 . . . . 0.0 110.455 179.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -49.81 -35.85 24.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.813 -179.719 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.703 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.35 -42.85 58.68 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.441 179.484 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -55.92 -29.03 59.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.036 0.446 . . . . 0.0 110.035 179.676 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.581 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -72.21 -32.56 66.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.057 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.703 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.3 mm? -50.02 -59.13 4.19 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.654 0.74 . . . . 0.0 110.913 179.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.734 ' O ' HG22 ' A' ' 41' ' ' THR . 0.2 OUTLIER -63.79 -44.27 93.87 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.7 -179.141 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 20' ' ' TYR . 32.0 t80 -58.01 -29.64 65.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.92 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.821 ' HG2' HG21 ' A' ' 47' ' ' THR . 1.1 ttm -78.08 -46.61 20.34 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.933 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.47 -19.74 63.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.028 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.816 HG23 ' HG2' ' A' ' 42' ' ' GLU . 5.9 t -94.35 -35.44 12.38 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.816 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.1 OUTLIER -128.78 20.23 6.03 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -177.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.5 HD21 HD11 ' B' ' 10' ' ' ILE . 13.7 mt -161.84 44.24 0.15 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.349 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.466 ' HB1' ' HG3' ' A' ' 48' ' ' LYS . . . -75.52 -23.93 56.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.87 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.68 -14.13 62.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.229 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.458 ' CD2' ' HB3' ' A' ' 87' ' ' CYS . 4.2 m-85 -110.97 11.08 22.2 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.355 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.821 HG21 ' HG2' ' A' ' 39' ' ' MET . 30.0 p -141.51 -34.98 0.47 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.466 ' HG3' ' HB1' ' A' ' 44' ' ' ALA . 37.4 mtpt -40.95 -79.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.742 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -18.09 55.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.207 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 67.78 23.76 8.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.951 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -61.15 141.16 57.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.508 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.627 ' HB3' ' CG1' ' A' ' 55' ' ' VAL . 10.0 t0 64.27 103.46 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -86.77 22.74 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.745 2.296 . . . . 0.0 113.129 -179.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -127.62 -0.56 6.68 Favored Glycine 0 CA--C 1.518 0.272 0 C-N-CA 120.572 -0.823 . . . . 0.0 113.054 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 86' ' ' ALA . 1.6 m -84.56 -51.05 14.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.179 0.514 . . . . 0.0 110.844 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.817 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -75.02 -52.01 12.15 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.908 -179.457 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.817 ' N ' HD23 ' A' ' 56' ' ' LEU . 5.4 t0 -56.45 -29.28 61.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.264 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -52.2 66.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.252 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.897 ' HE2' HD21 ' A' ' 83' ' ' LEU . 2.9 ptp -54.95 -52.85 61.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.927 0.394 . . . . 0.0 111.175 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.5 ' N ' ' CG ' ' A' ' 59' ' ' MET . 0.0 OUTLIER -62.77 -27.79 69.53 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.286 -179.424 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -40.21 39.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 0.0 110.391 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -80.13 -22.76 41.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.179 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.993 HD23 HD11 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -58.27 -46.08 86.68 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 121.108 0.48 . . . . 0.0 110.662 179.794 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 t70 65.07 49.38 2.05 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.948 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.51 HD21 ' HG ' ' A' ' 63' ' ' LEU . 2.3 mm? -51.75 94.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.018 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -174.93 -56.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 p -70.27 136.3 49.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.004 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 77.1 -50.38 0.55 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.89 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.62 21.14 20.04 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.043 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.481 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 2.2 mm-40 -159.83 166.82 29.55 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.878 0.371 . . . . 0.0 111.376 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.896 HD13 ' HG2' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -66.41 -139.02 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.255 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.511 ' C ' ' OE1' ' A' ' 75' ' ' GLU . 4.4 p-10 172.48 -157.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 118.347 0.521 . . . . 0.0 111.777 179.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.809 ' CD2' HG21 ' B' ' 85' ' ' VAL . 29.7 p90 -84.46 -59.93 2.23 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.524 ' N ' ' CG ' ' A' ' 73' ' ' PHE . 39.9 tp60 -76.98 -35.13 57.42 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -177.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.896 ' HG2' HD13 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -49.22 -26.53 2.98 Favored 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.005 179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.663 ' HE2' HD12 ' A' ' 30' ' ' LEU . 1.1 t80 -77.33 -54.05 6.94 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 178.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' B' ' 77' ' ' LEU . 8.0 mt -57.79 -33.56 68.69 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.401 ' N ' ' NE2' ' A' ' 74' ' ' GLN . 0.3 OUTLIER -76.68 -43.35 38.15 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.681 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.993 HD11 HD23 ' A' ' 63' ' ' LEU . 2.7 mp -58.08 -57.57 12.24 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.782 179.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.962 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -77.93 -44.17 28.34 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.061 179.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.507 ' HA3' ' O ' ' A' ' 77' ' ' LEU . . . -52.84 -50.17 51.33 Favored Glycine 0 CA--C 1.508 -0.363 0 C-N-CA 120.186 -1.007 . . . . 0.0 110.732 179.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.57 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.29 -41.13 46.89 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.147 -1.025 . . . . 0.0 111.394 178.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.897 HD21 ' HE2' ' A' ' 59' ' ' MET . 6.6 mt -57.91 -46.8 84.42 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.623 -0.339 . . . . 0.0 110.466 178.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.441 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -55.57 -31.95 62.62 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.051 0.453 . . . . 0.0 111.058 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.818 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.17 -17.6 9.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.512 -179.428 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB3' ' HB ' ' A' ' 55' ' ' VAL . . . -114.03 14.16 18.32 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.134 -179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.458 ' HB3' ' CD2' ' A' ' 46' ' ' PHE . 0.8 OUTLIER -156.19 -37.72 0.08 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.347 179.636 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 2.1 t60 -91.11 157.99 16.91 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 120.891 0.377 . . . . 0.0 111.081 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 93.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.052 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 6.3 m -150.29 -67.8 0.2 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.601 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.604 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -121.05 -32.54 3.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.01 179.722 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.454 HG13 ' HA ' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -51.94 -25.9 6.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.471 -179.892 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.58 50.93 1.79 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.842 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -154.98 -46.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.576 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -135.3 65.03 62.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.161 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.454 ' N ' ' HD2' ' A' ' 97' ' ' PRO . 48.5 Cg_exo -57.62 -46.89 24.09 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.74 2.294 . . . . 0.0 112.608 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 96' ' ' PRO . 87.9 Cg_endo -81.1 -39.35 0.21 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.392 2.061 . . . . 0.0 112.266 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.576 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.3 OUTLIER -62.51 147.45 48.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.879 -179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.64 104.2 1.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.935 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.05 99.5 0.64 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.855 -179.935 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.788 0.328 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.433 ' CB ' ' HG3' ' B' ' 7' ' ' GLU . 1.1 mpt_? 58.15 105.37 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.93 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -80.85 16.72 1.55 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 123.22 2.613 . . . . 0.0 114.267 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.733 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -54.43 144.34 21.24 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.36 0.6 . . . . 0.0 110.964 -179.271 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -44.45 -44.22 8.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.376 -179.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.851 ' O ' HD12 ' B' ' 10' ' ' ILE . 19.6 m -71.75 -38.03 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.35 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.733 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.7 OUTLIER -52.45 -53.36 46.52 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.915 0.388 . . . . 0.0 110.461 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -58.12 -26.66 62.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.574 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.58 ' HB3' HD22 ' A' ' 13' ' ' LEU . 74.2 m -74.59 -54.41 7.52 Favored 'General case' 0 C--N 1.334 -0.099 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.604 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.078 HG22 HD11 ' B' ' 14' ' ' ILE . 2.2 mp -54.72 -56.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.843 0.354 . . . . 0.0 111.615 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.968 ' HA ' HD12 ' B' ' 14' ' ' ILE . 1.8 mt-10 -52.38 -27.34 15.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.879 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.617 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.5 OUTLIER -63.02 -55.74 23.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.978 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.1 mm? -74.7 -27.83 60.56 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.078 HD11 HG22 ' B' ' 10' ' ' ILE . 6.7 mt -67.22 -35.93 75.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 O-C-N 121.612 -0.68 . . . . 0.0 110.859 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -79.09 -32.6 44.74 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.459 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.978 HG22 ' O ' ' B' ' 13' ' ' LEU . 23.2 m -52.57 -35.97 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 176.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.566 ' HB2' ' CG ' ' B' ' 76' ' ' PHE . 3.1 t80 -77.92 -59.03 2.95 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 113.923 -1.489 . . . . 0.0 110.683 179.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 3.8 mm-40 -49.68 -45.65 49.02 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -47.79 -51.72 21.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.614 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.525 ' HB3' HD21 ' B' ' 30' ' ' LEU . 3.4 m-85 -81.11 -31.91 34.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.627 0.727 . . . . 0.0 110.294 178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.485 ' HA ' HD23 ' B' ' 30' ' ' LEU . . . -86.74 20.12 2.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.931 -179.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -158.06 106.93 0.3 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.324 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.61 -50.02 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.763 0.316 . . . . 0.0 111.106 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -160.88 153.19 20.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.955 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.65 -92.07 0.51 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.593 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 m170 -109.64 169.44 8.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.864 0.364 . . . . 0.0 110.892 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 66.8 m -161.4 56.98 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.784 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 5.9 m -116.32 -24.12 3.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.663 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.486 HG22 ' HA ' ' B' ' 72' ' ' ASP . 3.3 p -140.69 153.19 45.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.291 0.567 . . . . 0.0 111.417 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.661 HD12 ' HE2' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -105.96 -154.19 0.51 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.956 179.376 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.494 ' H ' HD13 ' B' ' 30' ' ' LEU . 13.9 t -145.28 138.03 26.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.306 . . . . 0.0 110.462 179.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.475 ' HG2' ' N ' ' B' ' 33' ' ' THR . 0.0 OUTLIER -49.77 -35.92 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.776 -179.694 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.702 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.22 -42.94 58.95 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.425 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.456 ' O ' ' CE2' ' B' ' 20' ' ' TYR . 0.1 OUTLIER -55.94 -28.96 59.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.034 0.445 . . . . 0.0 110.059 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.569 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.8 OUTLIER -72.26 -32.61 66.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.028 178.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.702 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.3 mm? -49.96 -59.07 4.23 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.594 0.712 . . . . 0.0 110.863 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.755 ' O ' HG22 ' B' ' 41' ' ' THR . 0.2 OUTLIER -63.97 -44.09 93.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.631 -178.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.449 ' HB2' ' CZ ' ' B' ' 20' ' ' TYR . 31.9 t80 -58.16 -29.65 65.76 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.84 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.831 ' HG2' HG21 ' B' ' 47' ' ' THR . 1.1 ttm -78.03 -46.64 20.39 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.946 -179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -69.51 -19.63 63.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.082 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.811 HG23 ' HG2' ' B' ' 42' ' ' GLU . 5.9 t -94.45 -35.32 12.38 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.811 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.1 OUTLIER -128.86 20.3 5.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -177.804 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.482 HD21 HD11 ' A' ' 10' ' ' ILE . 13.7 mt -161.85 44.23 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.036 0.446 . . . . 0.0 110.413 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.469 ' HB1' ' HG3' ' B' ' 48' ' ' LYS . . . -75.44 -24.09 57.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.814 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.67 -13.98 62.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.246 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' B' ' 87' ' ' CYS . 4.1 m-85 -111.03 11.12 22.09 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.419 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.831 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p -141.6 -34.87 0.47 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.469 ' HG3' ' HB1' ' B' ' 44' ' ' ALA . 37.4 mtpt -41.0 -79.69 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.718 0.294 . . . . 0.0 111.718 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.07 -18.04 55.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.174 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 67.83 23.68 8.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.747 0.308 . . . . 0.0 110.997 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -61.16 141.16 57.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.501 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.638 ' HB3' ' CG1' ' B' ' 55' ' ' VAL . 10.1 t0 64.31 103.55 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.483 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -86.82 22.73 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.75 2.3 . . . . 0.0 113.185 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -127.6 -0.54 6.69 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.573 -0.822 . . . . 0.0 113.081 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.641 ' HB ' ' HB3' ' B' ' 86' ' ' ALA . 1.6 m -84.57 -51.1 14.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.154 0.502 . . . . 0.0 110.834 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.807 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -75.03 -51.91 12.39 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.944 -179.434 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.807 ' N ' HD23 ' B' ' 56' ' ' LEU . 5.4 t0 -56.56 -29.27 61.81 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.282 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -52.19 66.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.245 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.938 ' HE2' HD21 ' B' ' 83' ' ' LEU . 2.9 ptp -54.89 -52.9 61.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 111.236 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.493 ' N ' ' CG ' ' B' ' 59' ' ' MET . 0.0 OUTLIER -62.72 -27.7 69.45 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.36 -179.486 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.16 -40.14 38.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.423 . . . . 0.0 110.446 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 2.3 tmtp? -80.15 -22.73 41.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.177 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.992 HD23 HD11 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -58.33 -46.07 86.91 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.068 0.461 . . . . 0.0 110.599 179.856 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 t70 65.13 49.31 2.03 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.954 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.495 HD21 ' HG ' ' B' ' 63' ' ' LEU . 2.3 mm? -51.67 94.13 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.051 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -175.02 -56.19 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.954 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.5 p -70.31 136.28 49.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.937 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 77.1 -50.25 0.55 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.871 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.49 21.19 20.21 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.057 -179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.471 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 2.2 mm-40 -159.92 166.72 29.59 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.97 0.414 . . . . 0.0 111.324 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.847 HD13 ' HG2' ' B' ' 75' ' ' GLU . 0.2 OUTLIER -66.36 -139.02 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.212 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.504 ' C ' ' OE1' ' B' ' 75' ' ' GLU . 4.4 p-10 172.47 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 118.383 0.538 . . . . 0.0 111.799 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CG ' HG11 ' A' ' 85' ' ' VAL . 29.7 p90 -84.45 -59.92 2.23 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -178.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.51 ' N ' ' CG ' ' B' ' 73' ' ' PHE . 39.8 tp60 -76.94 -35.11 57.51 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.847 ' HG2' HD13 ' B' ' 71' ' ' LEU . 0.8 OUTLIER -49.25 -26.63 3.11 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.925 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.661 ' HE2' HD12 ' B' ' 30' ' ' LEU . 1.1 t80 -77.25 -54.08 6.93 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 178.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 1.072 HD22 HD22 ' A' ' 77' ' ' LEU . 8.0 mt -57.77 -33.51 68.58 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.403 ' N ' ' NE2' ' B' ' 74' ' ' GLN . 0.3 OUTLIER -76.71 -43.35 37.88 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.992 HD11 HD23 ' B' ' 63' ' ' LEU . 2.7 mp -58.2 -57.46 12.78 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.796 179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 1.0 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -77.92 -44.18 28.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.09 179.406 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' B' ' 77' ' ' LEU . . . -52.85 -50.11 51.66 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.178 -1.01 . . . . 0.0 110.747 179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.564 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -51.32 -41.16 47.18 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.14 -1.029 . . . . 0.0 111.375 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.938 HD21 ' HE2' ' B' ' 59' ' ' MET . 6.4 mt -57.87 -46.85 84.23 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-O 120.761 0.315 . . . . 0.0 110.53 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.438 ' HA ' ' HB2' ' B' ' 88' ' ' HIS . . . -55.47 -31.98 62.41 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.143 0.497 . . . . 0.0 111.205 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.809 HG21 ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.15 -17.53 9.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.586 -179.469 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.641 ' HB3' ' HB ' ' B' ' 55' ' ' VAL . . . -113.96 14.01 18.37 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.162 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.448 ' HB3' ' CD2' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -156.12 -37.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.321 179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 2.1 t60 -91.02 157.98 16.95 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.879 0.371 . . . . 0.0 111.118 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.38 93.82 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.975 -179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 6.6 m -150.43 -67.69 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.551 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.612 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -121.11 -32.59 3.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.96 179.726 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.444 HG13 ' HA ' ' B' ' 86' ' ' ALA . 0.9 OUTLIER -51.86 -25.99 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.53 -179.908 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.5 50.79 1.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.951 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -154.84 -46.28 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.217 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.576 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -135.38 65.14 62.09 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.06 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.449 ' N ' ' CD ' ' B' ' 97' ' ' PRO . 48.8 Cg_exo -57.64 -46.78 24.73 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.673 2.249 . . . . 0.0 112.648 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' B' ' 96' ' ' PRO . 86.3 Cg_endo -81.09 -39.38 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.41 2.073 . . . . 0.0 112.345 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.576 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -62.51 147.51 48.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.911 -179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -158.65 104.15 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.03 99.53 0.64 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.86 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.834 179.98 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.805 0.336 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.6 87.46 5.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.848 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -71.4 -2.86 11.92 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.003 2.468 . . . . 0.0 113.459 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.77 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -139.21 145.52 39.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.476 0.655 . . . . 0.0 111.702 -179.746 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.48 -48.97 37.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.755 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.941 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.4 m -60.49 -37.57 81.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.078 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.77 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.7 -36.64 47.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.014 0.435 . . . . 0.0 110.29 179.711 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.46 -26.96 41.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.342 178.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' B' ' 12' ' ' SER . 0.5 OUTLIER -65.37 -45.31 84.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.288 -179.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.134 HG22 HD11 ' A' ' 14' ' ' ILE . 3.2 mp -63.05 -56.77 15.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.46 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.965 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.72 -179.455 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.74 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.871 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.929 ' O ' HG22 ' A' ' 16' ' ' VAL . 4.0 mm? -71.97 -27.22 62.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.134 HD11 HG22 ' A' ' 10' ' ' ILE . 7.8 mt -66.9 -36.02 76.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.944 179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.75 -35.67 60.11 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.35 -1.296 . . . . 0.0 112.473 -176.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.929 HG22 ' O ' ' A' ' 13' ' ' LEU . 19.9 m -56.82 -35.68 47.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.479 0.657 . . . . 0.0 109.742 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.513 ' HB2' ' CB ' ' A' ' 76' ' ' PHE . 14.6 t80 -80.22 -59.91 2.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.889 -1.051 . . . . 0.0 112.757 -178.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.905 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -66.51 -29.63 69.77 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.335 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.43 -51.68 52.71 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.323 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.523 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.0 m-85 -80.35 -40.03 27.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.69 0.757 . . . . 0.0 109.538 177.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.905 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -56.89 -24.47 52.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.608 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 169.35 86.85 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.443 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 -40.61 65.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.712 0.292 . . . . 0.0 110.833 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.25 100.98 8.76 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.898 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.29 -163.72 12.95 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -58.42 -178.43 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.778 0.323 . . . . 0.0 110.892 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.38 97.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.12 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 14.2 p -113.37 -39.8 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.718 ' O ' ' HB1' ' A' ' 21' ' ' ALA . 20.8 p -136.4 -177.45 4.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.71 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -129.68 -128.24 0.21 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.632 -179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.631 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -170.97 130.47 0.79 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.409 ' CE ' ' HG2' ' A' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.33 43.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.944 0.402 . . . . 0.0 111.027 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.695 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -74.33 -43.42 56.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.482 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.7 mt-10 -55.82 -29.15 59.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.01 0.433 . . . . 0.0 110.428 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.509 ' CD1' ' CZ ' ' A' ' 76' ' ' PHE . 6.8 t80 -72.78 -26.8 61.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.371 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.695 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -56.76 -59.04 5.61 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.686 0.755 . . . . 0.0 111.3 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.891 ' O ' HG22 ' A' ' 41' ' ' THR . 0.7 OUTLIER -58.24 -32.52 68.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.572 -1.194 . . . . 0.0 111.274 -178.488 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -57.78 -38.18 75.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.696 ' SD ' HD12 ' A' ' 56' ' ' LEU . 0.0 OUTLIER -74.61 -35.4 62.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.201 0.524 . . . . 0.0 110.338 179.484 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -73.27 -19.25 61.1 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.46 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 37' ' ' SER . 3.7 t -107.65 -43.57 4.47 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -178.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.62 ' HG2' HG23 ' A' ' 41' ' ' THR . 1.2 mm-40 -127.85 -18.42 4.26 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 -176.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 10' ' ' ILE . 9.4 mt -120.27 49.56 1.41 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.273 0.559 . . . . 0.0 110.183 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 39' ' ' MET . . . -82.93 -29.37 29.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.926 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.75 30.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.59 179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 87' ' ' CYS . 47.8 m-85 -95.79 20.48 9.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.832 179.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t 178.43 39.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.745 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -102.09 -39.16 7.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.877 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.54 -25.01 14.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.784 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.41 41.72 4.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.082 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -51.29 -27.84 10.42 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.659 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -153.15 126.04 4.08 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.418 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -84.46 23.87 0.8 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.645 2.23 . . . . 0.0 112.88 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.424 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -124.32 4.3 8.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.976 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 86' ' ' ALA . 53.9 t -84.3 -63.99 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.946 0.373 . . . . 0.0 111.392 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.822 HD23 ' N ' ' A' ' 57' ' ' ASP . 0.1 OUTLIER -76.51 -52.57 9.54 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.066 0.46 . . . . 0.0 112.017 -179.491 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.822 ' N ' HD23 ' A' ' 56' ' ' LEU . 10.2 t0 -55.38 -59.08 5.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.196 -178.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 7.6 mmt180 -58.8 -35.59 73.09 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.832 ' HE2' HD21 ' A' ' 83' ' ' LEU . 3.2 tmm? -75.51 -43.78 47.18 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 120.426 0.155 . . . . 0.0 111.413 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.728 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -66.59 -37.35 84.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.856 0.36 . . . . 0.0 110.443 179.738 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.8 mtpt -78.4 -46.75 19.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.111 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.19 6.1 12.69 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.842 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.753 ' CG ' HD23 ' A' ' 65' ' ' LEU . 0.5 OUTLIER -60.23 -11.4 6.23 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.701 ' N ' HD23 ' A' ' 63' ' ' LEU . 0.2 OUTLIER 78.48 91.05 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.873 0.368 . . . . 0.0 110.979 179.792 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.753 HD23 ' CG ' ' A' ' 63' ' ' LEU . 0.9 OUTLIER -134.57 55.05 1.91 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.685 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -78.27 64.68 3.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.908 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.54 29.96 17.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.997 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -61.31 -46.91 88.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.811 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 139.71 77.79 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.525 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.432 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.4 OUTLIER 61.47 -170.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.697 0.284 . . . . 0.0 110.865 179.884 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' A' ' 75' ' ' GLU . 0.5 OUTLIER -65.0 -137.98 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.61 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 22.9 t70 171.78 161.24 0.1 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.436 0.562 . . . . 0.0 111.492 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.941 ' CG ' HG11 ' B' ' 85' ' ' VAL . 35.9 p90 -52.14 -59.77 3.99 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.644 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.526 HE22 ' HB2' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -79.66 -22.9 42.94 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.261 -179.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.942 ' O ' HD23 ' A' ' 79' ' ' LEU . 2.4 tt0 -45.41 -43.68 11.45 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.6 t80 -71.32 -54.41 10.9 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.301 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.472 HD21 ' HB3' ' A' ' 13' ' ' LEU . 5.4 mt -51.19 -38.56 52.99 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.183 0.516 . . . . 0.0 109.74 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.526 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -36.72 57.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.494 -0.776 . . . . 0.0 108.991 178.028 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.942 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -65.27 -57.54 8.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.288 -179.514 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.966 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -73.89 -43.84 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 178.636 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.45 ' N ' HG23 ' A' ' 80' ' ' ILE . . . -54.2 -50.99 53.68 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.164 -1.017 . . . . 0.0 110.65 179.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.58 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -53.05 -41.64 60.27 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.867 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.832 HD21 ' HE2' ' A' ' 59' ' ' MET . 3.3 mt -61.86 -42.26 98.84 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' ' 88' ' ' HIS . . . -54.42 -32.43 57.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.374 0.607 . . . . 0.0 110.188 179.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.932 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.67 -17.78 9.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.553 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.494 ' HB3' HG13 ' A' ' 55' ' ' VAL . . . -112.87 14.5 19.81 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.143 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 46' ' ' PHE . 52.8 t -157.94 -42.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.926 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.413 ' ND1' HD13 ' B' ' 14' ' ' ILE . 15.0 t-80 -90.31 162.93 14.95 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.872 0.368 . . . . 0.0 110.963 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.18 112.64 1.79 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.081 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.65 -53.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.665 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.808 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -127.39 -45.67 1.5 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.691 179.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.486 HG11 ' C ' ' A' ' 86' ' ' ALA . 30.8 m -60.26 -34.14 56.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.39 9.7 30.58 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.92 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.414 ' C ' ' HD3' ' A' ' 96' ' ' PRO . . . -137.2 29.38 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.901 ' HB1' ' HB2' ' A' ' 98' ' ' GLN . . . -129.54 57.94 34.07 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.566 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.459 ' HB2' ' HD3' ' A' ' 97' ' ' PRO . 52.6 Cg_exo -53.92 -47.12 28.86 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.332 2.021 . . . . 0.0 112.386 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.459 ' HD3' ' HB2' ' A' ' 96' ' ' PRO . 12.1 Cg_exo -69.57 -32.28 19.67 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.349 2.032 . . . . 0.0 111.581 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.901 ' HB2' ' HB1' ' A' ' 95' ' ' ALA . 0.9 OUTLIER -59.28 87.65 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.82 179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.2 pttt -104.52 148.29 26.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.016 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 -34.22 61.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.94 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.914 179.955 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.833 0.349 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.53 87.45 5.98 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -71.44 -2.86 11.93 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 123.007 2.471 . . . . 0.0 113.414 -179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.761 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -139.14 145.48 39.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.475 0.655 . . . . 0.0 111.713 -179.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.37 -49.07 36.0 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.752 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.912 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.4 m -60.44 -37.55 81.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.089 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.761 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.79 -36.69 48.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.008 0.432 . . . . 0.0 110.274 179.763 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -26.95 42.15 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.413 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.47 ' HB2' ' CB ' ' A' ' 12' ' ' SER . 0.5 OUTLIER -65.44 -45.3 84.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.227 -179.664 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.058 HG22 HD11 ' B' ' 14' ' ' ILE . 3.2 mp -63.1 -56.75 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.434 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.967 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.62 -27.26 16.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.702 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.508 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.2 OUTLIER -66.65 -55.86 13.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.928 ' O ' HG22 ' B' ' 16' ' ' VAL . 4.0 mm? -71.92 -27.16 62.64 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.058 HD11 HG22 ' B' ' 10' ' ' ILE . 7.8 mt -66.92 -36.04 76.2 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 O-C-N 121.751 -0.593 . . . . 0.0 110.998 179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.76 60.36 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 112.474 -176.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.928 HG22 ' O ' ' B' ' 13' ' ' LEU . 20.1 m -56.85 -35.63 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.458 0.647 . . . . 0.0 109.748 178.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.511 ' HB2' ' CB ' ' B' ' 76' ' ' PHE . 14.8 t80 -80.16 -59.98 2.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.737 -178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HA ' ' HB3' ' B' ' 21' ' ' ALA . 0.3 OUTLIER -66.44 -29.68 69.87 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.47 -51.68 52.96 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.318 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.52 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.0 m-85 -80.3 -39.99 27.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.708 0.766 . . . . 0.0 109.66 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.883 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -56.91 -24.41 52.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.623 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . 169.37 86.78 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.459 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -40.63 65.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.834 0.35 . . . . 0.0 110.899 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.25 101.05 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.864 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 118.29 -163.71 12.96 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.547 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 14.8 p-80 -58.41 -178.35 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.705 0.288 . . . . 0.0 110.953 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -164.46 98.01 0.79 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.11 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.403 HG13 ' N ' ' B' ' 29' ' ' THR . 13.9 p -113.52 -39.76 3.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.776 179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.722 ' O ' ' HB1' ' B' ' 21' ' ' ALA . 20.6 p -136.4 -177.39 4.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.609 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.689 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.0 OUTLIER -129.67 -128.24 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.61 -179.985 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.624 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.1 OUTLIER -170.96 130.5 0.79 Allowed 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.649 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.404 ' CE ' ' HG2' ' B' ' 60' ' ' MET . 0.0 OUTLIER -49.75 -41.31 43.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.017 -179.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -74.36 -43.33 57.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.997 179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.474 ' HB3' HD21 ' B' ' 30' ' ' LEU . 1.7 mt-10 -55.99 -29.02 59.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.079 0.466 . . . . 0.0 110.425 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.507 ' CE1' ' CZ ' ' B' ' 76' ' ' PHE . 6.9 t80 -72.77 -27.0 61.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.289 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -56.64 -59.02 5.62 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.597 0.713 . . . . 0.0 111.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.87 ' O ' HG22 ' B' ' 41' ' ' THR . 0.7 OUTLIER -58.23 -32.51 68.39 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.303 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.78 -38.2 75.05 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.693 ' SD ' HD12 ' B' ' 56' ' ' LEU . 0.0 OUTLIER -74.65 -35.33 62.85 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.154 0.502 . . . . 0.0 110.326 179.459 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -73.28 -19.17 61.11 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.476 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.87 HG22 ' O ' ' B' ' 37' ' ' SER . 3.7 t -107.61 -43.71 4.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' B' ' 41' ' ' THR . 1.2 mm-40 -127.76 -18.53 4.27 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -176.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.724 HD21 HD11 ' A' ' 10' ' ' ILE . 9.4 mt -120.14 49.51 1.4 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.312 0.577 . . . . 0.0 110.304 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' B' ' 39' ' ' MET . . . -82.94 -29.3 29.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.919 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.31 -24.74 30.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.57 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.415 ' CD1' ' HB3' ' B' ' 87' ' ' CYS . 47.4 m-85 -95.86 20.52 9.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.725 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.7 t 178.47 39.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.709 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.9 pttm -102.11 -39.07 7.44 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.896 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -98.56 -25.01 14.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.736 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 65.49 41.64 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.039 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -51.26 -27.79 10.13 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.75 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -153.23 126.01 4.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.436 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -84.45 24.03 0.79 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.572 2.181 . . . . 0.0 112.921 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -124.37 4.16 8.84 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.922 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.486 HG13 ' HB3' ' B' ' 86' ' ' ALA . 54.2 t -84.28 -63.97 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.977 0.389 . . . . 0.0 111.377 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.834 HD23 ' N ' ' B' ' 57' ' ' ASP . 0.1 OUTLIER -76.49 -52.59 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.056 0.455 . . . . 0.0 112.03 -179.532 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.834 ' N ' HD23 ' B' ' 56' ' ' LEU . 10.2 t0 -55.34 -59.07 5.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.273 -178.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 7.6 mmt180 -58.8 -35.68 73.24 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.838 ' HE2' HD21 ' B' ' 83' ' ' LEU . 3.2 tmm? -75.38 -43.88 47.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 120.436 0.16 . . . . 0.0 111.41 -179.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.719 ' O ' HD22 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -66.55 -37.42 84.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.858 0.361 . . . . 0.0 110.428 179.793 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 13.7 mtpt -78.33 -46.78 19.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 6.13 12.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.888 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.755 ' CG ' HD23 ' B' ' 65' ' ' LEU . 0.5 OUTLIER -60.26 -11.39 6.27 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.699 ' N ' HD23 ' B' ' 63' ' ' LEU . 0.2 OUTLIER 78.58 90.93 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.779 0.323 . . . . 0.0 111.01 179.781 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.755 HD23 ' CG ' ' B' ' 63' ' ' LEU . 0.9 OUTLIER -134.56 55.1 1.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.68 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -78.25 64.7 3.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.883 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 57.55 29.88 17.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.986 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -61.28 -46.93 88.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.828 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 139.73 77.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.51 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.417 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.4 OUTLIER 61.4 -170.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.868 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.714 HD13 ' OE1' ' B' ' 75' ' ' GLU . 0.5 OUTLIER -65.1 -138.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.591 ' HB3' ' HB2' ' B' ' 75' ' ' GLU . 22.8 t70 171.78 161.3 0.1 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 118.453 0.569 . . . . 0.0 111.462 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.932 ' CG ' HG11 ' A' ' 85' ' ' VAL . 35.6 p90 -52.16 -59.79 3.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.626 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.53 HE22 ' HB2' ' B' ' 78' ' ' ASN . 0.0 OUTLIER -79.69 -22.91 42.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.069 -0.652 . . . . 0.0 111.16 -179.32 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.945 ' O ' HD23 ' B' ' 79' ' ' LEU . 2.4 tt0 -45.42 -43.7 11.49 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.53 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.6 t80 -71.3 -54.39 10.99 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.356 178.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.47 HD21 ' HB3' ' B' ' 13' ' ' LEU . 5.3 mt -51.21 -38.65 53.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.195 0.521 . . . . 0.0 109.667 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.53 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.37 -36.58 58.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.049 178.022 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.945 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -65.36 -57.63 7.88 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.264 -179.564 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.958 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -73.71 -43.82 53.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.419 178.619 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.453 ' N ' HG23 ' B' ' 80' ' ' ILE . . . -54.13 -51.0 53.35 Favored Glycine 0 C--N 1.335 0.502 0 C-N-CA 120.141 -1.028 . . . . 0.0 110.705 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.582 ' O ' HG23 ' B' ' 85' ' ' VAL . . . -53.07 -41.64 60.46 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.895 178.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.838 HD21 ' HE2' ' B' ' 59' ' ' MET . 3.4 mt -61.91 -42.28 98.91 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.27 -32.53 56.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.941 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.72 9.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.621 -179.75 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.486 ' HB3' HG13 ' B' ' 55' ' ' VAL . . . -113.01 14.58 19.66 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.077 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.415 ' HB3' ' CD1' ' B' ' 46' ' ' PHE . 52.9 t -158.03 -42.27 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.404 ' ND1' HD13 ' A' ' 14' ' ' ILE . 14.8 t-80 -90.32 162.93 14.94 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.821 0.343 . . . . 0.0 110.972 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.21 112.61 1.78 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.059 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.67 -53.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.755 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.847 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.7 OUTLIER -127.54 -45.58 1.48 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.711 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.479 HG11 ' C ' ' B' ' 86' ' ' ALA . 30.9 m -60.25 -34.13 56.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.031 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.41 9.71 30.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.953 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . 0.405 ' C ' ' HD3' ' B' ' 96' ' ' PRO . . . -137.27 29.34 2.74 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.987 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.911 ' HB1' ' HB2' ' B' ' 98' ' ' GLN . . . -129.49 57.95 34.08 Favored Pre-proline 0 CA--C 1.532 0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.544 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.456 ' HB2' ' HD3' ' B' ' 97' ' ' PRO . 52.7 Cg_exo -53.93 -47.07 29.11 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.335 2.024 . . . . 0.0 112.482 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' B' ' 96' ' ' PRO . 12.1 Cg_exo -69.6 -32.19 19.73 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.306 2.004 . . . . 0.0 111.658 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.911 ' HB2' ' HB1' ' B' ' 95' ' ' ALA . 0.9 OUTLIER -59.36 87.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.797 179.926 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 12.1 pttt -104.45 148.27 26.63 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -34.33 61.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.331 -0.842 . . . . 0.0 110.827 -179.95 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 94.8 p . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.828 0.347 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.19 128.18 0.92 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.886 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -68.3 -102.5 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.732 2.288 . . . . 0.0 112.196 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.719 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -170.75 144.26 2.25 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.351 0.596 . . . . 0.0 111.156 179.957 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.96 -49.07 11.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.998 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.965 ' O ' HD12 ' A' ' 10' ' ' ILE . 0.6 OUTLIER -62.55 -40.42 96.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.087 179.121 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.719 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -51.1 -36.64 41.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.633 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.67 -26.89 40.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.707 178.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.627 ' HB2' HD22 ' B' ' 13' ' ' LEU . 1.6 p -66.86 -42.2 86.08 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.513 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.04 HG22 HD11 ' A' ' 14' ' ' ILE . 3.5 mp -70.98 -54.65 16.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.776 0.322 . . . . 0.0 111.682 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.973 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.0 OUTLIER -51.94 -27.28 12.63 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -178.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.622 ' O ' HG13 ' A' ' 16' ' ' VAL . 16.6 m -75.73 -55.87 5.23 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.777 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.808 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.8 mm? -58.82 -27.06 64.72 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.04 HD11 HG22 ' A' ' 10' ' ' ILE . 8.8 mt -73.54 -38.67 52.85 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 CA-C-O 121.489 0.661 . . . . 0.0 110.357 178.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' A' ' 19' ' ' LYS . . . -73.63 -37.15 65.46 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.787 -177.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.808 HG22 ' O ' ' A' ' 13' ' ' LEU . 18.8 m -56.81 -36.29 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-O 121.463 0.649 . . . . 0.0 109.815 178.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.499 ' HA ' ' CD2' ' A' ' 76' ' ' PHE . 4.2 t80 -79.81 -59.92 2.55 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 114.988 -1.005 . . . . 0.0 112.664 -178.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.849 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 0.5 OUTLIER -64.42 -39.45 93.86 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -178.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 11.7 tppt? -47.89 -50.69 25.86 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.812 0.339 . . . . 0.0 110.817 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.528 ' HB2' HD11 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -79.35 -39.83 31.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.769 0.795 . . . . 0.0 109.344 178.464 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.819 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . . . -59.36 -19.02 43.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.24 -1.345 . . . . 0.0 112.063 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 18' ' ' GLN . . . -119.69 -35.95 0.87 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.627 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.7 mtmt 68.18 -66.72 0.22 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.788 0.328 . . . . 0.0 110.692 -179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -110.18 27.72 9.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.764 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.49 -97.39 0.18 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.519 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -171.95 136.17 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.5 t -140.55 25.93 2.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.192 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.433 ' O ' ' OG1' ' A' ' 29' ' ' THR . 28.5 t 64.59 135.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.215 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' A' ' 28' ' ' VAL . 3.5 p 56.33 154.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.817 -0.628 . . . . 0.0 111.375 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.62 ' HG ' ' HB2' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -101.99 -128.9 0.23 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.27 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.472 ' N ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -171.81 123.79 0.53 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.391 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.456 ' O ' HD23 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -49.68 -36.33 24.66 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.128 -179.244 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.1 m -74.21 -42.0 60.48 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.646 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.38 -28.59 68.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.114 0.483 . . . . 0.0 109.963 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.757 ' CD2' HD23 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -72.05 -31.62 66.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.958 179.166 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.4 mm? -50.87 -59.17 4.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.683 0.754 . . . . 0.0 111.517 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.75 -55.18 28.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.584 -1.189 . . . . 0.0 111.446 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.51 ' CD2' ' CG ' ' A' ' 20' ' ' TYR . 21.2 m-85 -57.91 -35.6 71.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.166 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.622 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.1 OUTLIER -72.61 -27.6 62.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.602 179.532 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.802 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 25.6 m-20 -73.71 -19.6 60.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.719 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.49 -80.74 0.58 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.669 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.39 -30.66 3.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.781 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.556 HD21 HD11 ' B' ' 10' ' ' ILE . 30.5 mt -133.64 51.67 2.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.004 0.43 . . . . 0.0 110.761 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.802 ' HB2' ' O ' ' A' ' 40' ' ' ASN . . . -78.78 -41.49 30.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.884 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.87 24.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.245 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -82.6 -40.53 20.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.622 HG21 ' HG2' ' A' ' 39' ' ' MET . 29.9 p -88.81 -84.93 0.2 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.807 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.482 ' N ' ' OG1' ' A' ' 47' ' ' THR . 6.4 mmmt 36.56 -96.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.831 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -157.92 43.87 0.32 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.897 0.38 . . . . 0.0 110.662 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -52.65 -178.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.133 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.54 27.16 3.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.824 179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -145.07 101.23 4.49 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.766 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.23 2.2 7.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.527 2.152 . . . . 0.0 112.862 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.45 -23.16 24.83 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.821 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 86' ' ' ALA . 34.6 t -47.99 -61.44 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.771 0.32 . . . . 0.0 111.406 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.61 ' O ' ' HG2' ' A' ' 59' ' ' MET . 10.8 tp -68.69 -45.11 72.52 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.557 0.694 . . . . 0.0 110.465 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 1.8 t70 -55.6 -26.51 44.34 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.846 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.14 -53.67 10.43 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.471 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.954 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.1 OUTLIER -55.92 -53.79 52.58 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.004 0.431 . . . . 0.0 111.633 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.517 ' N ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -65.14 -22.8 66.98 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.083 -179.097 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -67.87 -61.08 2.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.849 0.357 . . . . 0.0 111.416 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.86 -26.42 68.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.95 ' HB2' HD11 ' A' ' 79' ' ' LEU . 1.7 tt -60.16 -19.24 52.95 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t70 63.93 54.9 1.66 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.016 0.436 . . . . 0.0 109.864 -179.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.891 HD23 ' CD2' ' A' ' 63' ' ' LEU . 35.7 mt -39.13 113.38 0.31 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.876 -179.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -153.02 133.33 13.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.697 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.7 m -77.17 -22.61 52.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.229 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -94.13 42.71 1.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.844 0.354 . . . . 0.0 110.978 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.449 ' O ' ' HG2' ' A' ' 70' ' ' GLN . . . -154.93 -119.54 0.68 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.516 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 69' ' ' GLY . 1.5 mm-40 167.46 167.25 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.762 0.315 . . . . 0.0 110.488 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.865 HD21 HD11 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -70.39 -138.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.136 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.512 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.5 OUTLIER 172.39 179.04 0.08 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 118.516 0.598 . . . . 0.0 111.715 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.92 ' CG ' HG11 ' B' ' 85' ' ' VAL . 44.2 p90 -64.78 -57.65 8.35 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.336 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -78.81 -20.99 48.41 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.069 -0.653 . . . . 0.0 110.076 179.281 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.834 ' O ' HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -45.1 -36.86 3.87 Favored 'General case' 0 CA--C 1.52 -0.198 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 178.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CZ ' ' CZ ' ' A' ' 35' ' ' PHE . 2.9 t80 -80.2 -54.24 5.93 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.799 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' B' ' 77' ' ' LEU . 7.2 mt -51.83 -34.09 38.9 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.175 0.512 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.44 ' HB2' HE22 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.41 -48.99 17.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.223 178.009 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.95 HD11 ' HB2' ' A' ' 63' ' ' LEU . 5.3 mp -59.78 -58.19 9.65 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.868 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.786 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -71.24 -46.46 65.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.843 179.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.552 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -52.84 -50.35 50.53 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.102 -1.047 . . . . 0.0 110.525 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.462 ' HA2' HG23 ' A' ' 85' ' ' VAL . . . -52.11 -32.79 36.29 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.583 178.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.954 HD21 ' HE3' ' A' ' 59' ' ' MET . 14.1 mt -64.48 -46.6 82.32 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 120.901 0.381 . . . . 0.0 110.12 179.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.571 ' HB2' HG23 ' B' ' 10' ' ' ILE . . . -55.09 -32.87 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.625 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.905 HG11 ' CG ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -85.6 -17.6 9.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.403 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.94 12.75 14.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.671 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.491 ' N ' ' O ' ' A' ' 83' ' ' LEU . 53.6 t -152.45 -43.53 0.1 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.879 -179.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 0.9 OUTLIER -84.11 148.82 26.59 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.75 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.36 85.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.213 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.438 ' O ' ' CB ' ' A' ' 91' ' ' PHE . 41.0 p -179.59 102.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.744 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.575 ' CB ' HG12 ' A' ' 85' ' ' VAL . 0.5 OUTLIER 82.85 -30.13 0.09 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.8 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 85' ' ' VAL . 60.4 t -52.33 100.84 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 tttp 54.48 28.63 9.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.112 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.594 ' HB1' ' HG2' ' A' ' 97' ' ' PRO . . . 57.73 54.07 6.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.148 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.644 ' HB3' ' CD ' ' A' ' 96' ' ' PRO . . . -64.01 -64.25 3.04 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.097 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.644 ' CD ' ' HB3' ' A' ' 95' ' ' ALA . 0.9 OUTLIER -40.78 -54.17 2.52 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 123.405 2.736 . . . . 0.0 113.242 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.594 ' HG2' ' HB1' ' A' ' 94' ' ' ALA . 44.4 Cg_endo -67.41 -9.75 26.36 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.354 2.036 . . . . 0.0 112.712 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -94.25 29.8 2.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.33 . . . . 0.0 111.183 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.8 mttm 57.23 -169.89 0.1 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.078 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 75.2 ttt-85 -83.65 -66.87 0.84 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.937 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 38.6 p90 . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.307 -0.854 . . . . 0.0 110.914 -179.954 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 95.1 p . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.809 0.337 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.17 128.16 0.92 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.978 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -68.26 -102.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.715 2.276 . . . . 0.0 112.273 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.715 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -170.72 144.24 2.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 111.145 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -44.92 -49.11 11.22 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.998 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.977 ' O ' HD12 ' B' ' 10' ' ' ILE . 0.6 OUTLIER -62.44 -40.44 96.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.155 179.025 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -51.16 -36.58 41.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.61 -179.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -79.77 -26.88 40.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.66 179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.61 ' HB2' HD22 ' A' ' 13' ' ' LEU . 1.6 p -66.79 -42.26 86.28 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.519 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 0.989 HG22 HD11 ' B' ' 14' ' ' ILE . 3.5 mp -71.04 -54.63 16.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.597 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.992 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.0 OUTLIER -52.01 -27.27 12.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.529 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.639 ' O ' HG13 ' B' ' 16' ' ' VAL . 16.6 m -75.67 -55.83 5.27 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.909 -0.317 . . . . 0.0 111.833 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.814 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.8 mm? -58.83 -27.17 64.85 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' B' ' 11' ' ' GLU . 8.8 mt -73.44 -38.73 53.62 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 CA-C-O 121.433 0.635 . . . . 0.0 110.34 178.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . 0.405 ' O ' ' CB ' ' B' ' 19' ' ' LYS . . . -73.62 -37.1 65.49 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.037 -1.438 . . . . 0.0 111.824 -177.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.814 HG22 ' O ' ' B' ' 13' ' ' LEU . 18.8 m -56.85 -36.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.429 0.633 . . . . 0.0 109.81 178.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.497 ' HA ' ' CD2' ' B' ' 76' ' ' PHE . 4.2 t80 -79.8 -60.03 2.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.661 -178.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 0.5 OUTLIER -64.34 -39.48 93.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -178.602 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' B' ' 15' ' ' ALA . 11.7 tppt? -47.9 -50.68 25.96 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.852 0.358 . . . . 0.0 110.888 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.518 ' HB2' HD11 ' B' ' 30' ' ' LEU . 0.8 OUTLIER -79.25 -39.88 31.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.8 0.81 . . . . 0.0 109.335 178.404 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.842 ' HB3' ' HA ' ' B' ' 18' ' ' GLN . . . -59.45 -19.04 44.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.985 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . -119.74 -35.74 0.89 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.663 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt 68.19 -66.75 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.676 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -110.12 27.65 9.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.767 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.48 -97.28 0.18 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.525 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -171.99 136.08 0.86 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.803 0.335 . . . . 0.0 110.802 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 29.6 t -140.49 25.91 2.18 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.142 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . 0.407 ' O ' ' OG1' ' B' ' 29' ' ' THR . 28.8 t 64.67 135.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.221 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' B' ' 28' ' ' VAL . 3.7 p 56.39 154.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.392 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.591 ' HG ' ' HB2' ' B' ' 21' ' ' ALA . 0.2 OUTLIER -102.02 -128.91 0.23 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.255 -179.846 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.479 ' N ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -171.76 123.83 0.54 Allowed 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.457 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.0 OUTLIER -49.64 -36.38 24.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.087 -179.207 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.662 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.1 m -74.16 -42.11 60.45 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -60.28 -28.69 68.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.09 0.472 . . . . 0.0 109.925 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.764 ' CD2' HD23 ' B' ' 79' ' ' LEU . 0.2 OUTLIER -71.95 -31.72 66.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.207 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.662 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -50.81 -59.26 4.29 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.588 0.709 . . . . 0.0 111.49 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.71 -55.14 29.45 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.578 -1.192 . . . . 0.0 111.527 -178.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.517 ' CD2' ' CG ' ' B' ' 20' ' ' TYR . 21.1 m-85 -57.87 -35.65 71.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.146 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.614 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.1 OUTLIER -72.63 -27.61 62.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.541 179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.788 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 25.6 m-20 -73.62 -19.7 60.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.7 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -110.37 -80.93 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.668 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -47.28 -30.6 3.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.848 -179.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.553 HD21 HD11 ' A' ' 10' ' ' ILE . 30.3 mt -133.74 51.65 2.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.105 0.479 . . . . 0.0 110.813 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.788 ' HB2' ' O ' ' B' ' 40' ' ' ASN . . . -78.74 -41.53 30.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.835 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -53.64 -26.8 23.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.194 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -82.73 -40.52 20.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.806 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.614 HG21 ' HG2' ' B' ' 39' ' ' MET . 30.0 p -88.76 -84.93 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.48 ' N ' ' OG1' ' B' ' 47' ' ' THR . 6.5 mmmt 36.58 -96.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -157.89 43.87 0.32 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.817 0.342 . . . . 0.0 110.624 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -52.62 -178.58 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.103 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.59 27.18 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.867 179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -145.1 101.29 4.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.742 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.23 2.13 7.56 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.617 2.211 . . . . 0.0 112.839 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.47 -23.17 24.74 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.767 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 86' ' ' ALA . 34.1 t -48.04 -61.41 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.696 0.284 . . . . 0.0 111.409 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.6 ' O ' ' HG2' ' B' ' 59' ' ' MET . 10.7 tp -68.66 -45.11 72.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.578 0.704 . . . . 0.0 110.502 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 1.8 t70 -55.49 -26.6 43.56 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.856 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -73.21 -53.65 10.38 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.387 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.958 ' HE3' HD21 ' B' ' 83' ' ' LEU . 0.1 OUTLIER -55.9 -53.79 52.51 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.018 0.437 . . . . 0.0 111.6 -179.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.538 ' HE3' ' HG ' ' B' ' 79' ' ' LEU . 0.0 OUTLIER -65.1 -22.74 66.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.147 -179.135 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -68.02 -61.04 2.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.731 0.3 . . . . 0.0 111.33 -179.717 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -26.3 68.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.804 -179.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.934 ' HB2' HD11 ' B' ' 79' ' ' LEU . 1.7 tt -60.23 -19.15 53.28 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 14.1 t70 63.83 54.94 1.7 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.032 0.444 . . . . 0.0 109.907 -179.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.904 ' CD2' HD22 ' B' ' 63' ' ' LEU . 35.3 mt -39.07 113.35 0.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.868 -179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -153.0 133.38 13.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.653 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 66.3 m -77.29 -22.53 51.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.194 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -94.18 42.71 1.1 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.864 0.364 . . . . 0.0 110.977 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.441 ' O ' ' HG2' ' B' ' 70' ' ' GLN . . . -154.9 -119.6 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.363 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' B' ' 69' ' ' GLY . 1.5 mm-40 167.38 167.23 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.878 HD21 HD11 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -70.41 -138.16 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 179.209 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.503 ' H ' ' HB3' ' B' ' 71' ' ' LEU . 0.5 OUTLIER 172.38 179.13 0.08 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 118.463 0.574 . . . . 0.0 111.746 179.723 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.905 ' CG ' HG11 ' A' ' 85' ' ' VAL . 43.9 p90 -64.75 -57.73 8.15 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.349 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.458 ' N ' ' CD2' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -78.85 -20.91 48.47 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.027 179.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.827 ' O ' HD13 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -45.04 -37.01 3.82 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.765 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.532 ' CZ ' ' CZ ' ' B' ' 35' ' ' PHE . 3.0 t80 -80.21 -54.16 6.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.792 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.575 HD22 HD22 ' A' ' 77' ' ' LEU . 7.3 mt -51.84 -34.04 38.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.194 0.521 . . . . 0.0 109.733 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.44 ' HB2' HE22 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.5 -48.98 17.72 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.172 178.034 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.934 HD11 ' HB2' ' B' ' 63' ' ' LEU . 5.3 mp -59.8 -58.13 9.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.869 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.789 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -71.29 -46.42 65.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.84 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.565 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -52.78 -50.4 49.98 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.126 -1.035 . . . . 0.0 110.555 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.485 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -52.22 -32.69 36.89 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.6 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.958 HD21 ' HE3' ' B' ' 59' ' ' MET . 14.2 mt -64.47 -46.58 82.45 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.979 0.419 . . . . 0.0 110.134 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.593 ' HB2' HG23 ' A' ' 10' ' ' ILE . . . -55.14 -32.89 62.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.603 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.92 HG11 ' CG ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -85.52 -17.65 9.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.497 179.809 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.536 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.92 12.94 14.84 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.67 -179.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.494 ' N ' ' O ' ' B' ' 83' ' ' LEU . 53.6 t -152.55 -43.49 0.1 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.851 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.495 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 0.9 OUTLIER -84.22 148.83 26.51 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.764 179.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.39 85.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.424 ' O ' ' CB ' ' B' ' 91' ' ' PHE . 40.8 p -179.52 102.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.571 ' CB ' HG12 ' B' ' 85' ' ' VAL . 0.5 OUTLIER 83.01 -30.15 0.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.765 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.544 HG22 ' O ' ' B' ' 85' ' ' VAL . 60.3 t -52.37 100.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.915 0.388 . . . . 0.0 111.299 -179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 1.2 tttp 54.27 28.76 9.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.174 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . 0.574 ' HB1' ' HG2' ' B' ' 97' ' ' PRO . . . 57.65 54.19 6.57 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.076 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.644 ' HB3' ' CD ' ' B' ' 96' ' ' PRO . . . -64.01 -64.26 3.03 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.117 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.644 ' CD ' ' HB3' ' B' ' 95' ' ' ALA . 0.9 OUTLIER -40.87 -54.03 2.62 Favored 'Trans proline' 0 CA--C 1.533 0.456 0 C-N-CA 123.381 2.721 . . . . 0.0 113.207 -179.885 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.574 ' HG2' ' HB1' ' B' ' 94' ' ' ALA . 43.8 Cg_endo -67.53 -9.69 26.23 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.303 2.002 . . . . 0.0 112.711 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -94.23 29.64 2.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.73 0.3 . . . . 0.0 111.115 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 11.8 mttm 57.33 -169.89 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.089 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -83.75 -66.81 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.916 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 39.2 p90 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.895 179.976 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.74 0.305 . . . . 0.0 111.215 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 45.4 mtt180 -99.87 110.75 60.24 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.04 -100.85 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.633 2.222 . . . . 0.0 112.278 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.624 HG23 ' HB2' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -175.24 144.97 0.75 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.375 0.607 . . . . 0.0 111.149 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -45.02 -40.1 6.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.117 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.956 ' O ' HD12 ' A' ' 10' ' ' ILE . 1.7 m -70.16 -37.43 75.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.233 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.624 ' HB2' HG23 ' A' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.66 60.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.015 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -77.4 -26.82 52.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.683 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.608 ' HB3' HD22 ' B' ' 13' ' ' LEU . 81.8 m -72.29 -51.87 18.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.177 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 1.079 HG22 HD11 ' A' ' 14' ' ' ILE . 2.7 mp -52.89 -56.24 8.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.6 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 1.031 ' HA ' HD12 ' A' ' 14' ' ' ILE . 0.3 OUTLIER -52.36 -27.51 15.86 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -178.846 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -66.01 -55.71 15.3 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.966 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.038 ' O ' HG22 ' A' ' 16' ' ' VAL . 3.9 mm? -71.19 -27.69 63.69 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.079 HD11 HG22 ' A' ' 10' ' ' ILE . 7.7 mt -67.3 -37.45 79.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.546 0.688 . . . . 0.0 110.882 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.03 -32.88 61.7 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.357 -1.292 . . . . 0.0 112.376 -176.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.038 HG22 ' O ' ' A' ' 13' ' ' LEU . 23.1 m -52.63 -38.21 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.489 ' N ' HG23 ' A' ' 16' ' ' VAL . 4.6 t80 -77.5 -58.05 3.48 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.529 179.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.81 ' HG2' ' O ' ' A' ' 14' ' ' ILE . 1.3 mm-40 -49.13 -35.8 17.41 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.839 -179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.1 -52.26 59.19 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.294 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.844 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.8 m-85 -81.28 -47.36 13.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.771 0.796 . . . . 0.0 110.093 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.565 ' HB2' ' HG ' ' A' ' 30' ' ' LEU . . . -56.89 -21.06 26.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.867 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.01 165.1 51.35 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.401 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt 61.22 101.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.801 0.334 . . . . 0.0 110.877 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -162.05 -46.16 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.87 -37.89 0.93 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.603 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -177.26 -39.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 110.939 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 p -57.67 147.76 26.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.979 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.4 m -112.37 55.68 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.12 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 70' ' ' GLN . 20.9 p -133.99 172.75 12.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.297 0.57 . . . . 0.0 110.778 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.844 HD21 ' HB3' ' A' ' 20' ' ' TYR . 0.4 OUTLIER -114.38 -144.76 0.39 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.587 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.527 ' H ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -160.63 138.11 9.38 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.531 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -41.53 44.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.101 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.735 ' O ' ' HB2' ' A' ' 36' ' ' LEU . 1.0 OUTLIER -71.91 -45.31 61.68 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.831 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.416 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 3.6 mt-10 -57.57 -28.95 64.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.156 0.503 . . . . 0.0 109.97 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.451 ' CE2' ' CB ' ' A' ' 79' ' ' LEU . 0.1 OUTLIER -67.49 -32.97 74.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.805 178.709 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.735 ' HB2' ' O ' ' A' ' 33' ' ' THR . 3.5 mm? -51.01 -59.2 4.41 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.515 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.613 ' O ' HG22 ' A' ' 41' ' ' THR . 68.8 m -54.09 -48.64 70.46 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.593 -178.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.527 ' HA ' HG22 ' A' ' 41' ' ' THR . 31.8 t80 -57.92 -27.42 63.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.893 0.377 . . . . 0.0 110.966 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.932 ' HG2' HG21 ' A' ' 47' ' ' THR . 0.0 OUTLIER -73.7 -58.25 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.196 -179.809 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.423 ' O ' ' HB2' ' A' ' 44' ' ' ALA . 1.9 p30 -65.38 -19.36 65.91 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.948 HG23 ' HG2' ' A' ' 42' ' ' GLU . 13.3 t -96.08 -31.73 12.88 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.84 0.681 . . . . 0.0 112.84 -178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.948 ' HG2' HG23 ' A' ' 41' ' ' THR . 0.9 OUTLIER -129.29 14.67 6.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -177.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.879 HD12 ' HE2' ' A' ' 39' ' ' MET . 40.2 mt -161.93 41.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 109.692 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.578 ' HB1' ' HG3' ' A' ' 48' ' ' LYS . . . -75.67 -26.24 57.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.86 -7.7 36.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.05 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -112.25 -13.84 13.42 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.621 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.932 HG21 ' HG2' ' A' ' 39' ' ' MET . 3.2 p -124.13 -17.49 6.18 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.578 ' HG3' ' HB1' ' A' ' 44' ' ' ALA . 24.7 mttm -47.3 126.49 9.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.973 0.416 . . . . 0.0 111.486 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 63.75 13.73 7.68 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.37 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.66 30.98 0.41 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-O 120.797 0.332 . . . . 0.0 111.39 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mmtm -48.68 -29.39 4.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.939 0.4 . . . . 0.0 110.82 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.734 ' HB3' HG23 ' A' ' 55' ' ' VAL . 0.6 OUTLIER -130.03 88.27 49.03 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.484 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.4 -1.62 7.66 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.872 2.381 . . . . 0.0 113.051 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' A' ' 58' ' ' ARG . . . -98.2 -2.15 58.04 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.881 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.774 HG12 HD22 ' A' ' 83' ' ' LEU . 32.6 t -84.48 -63.2 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.916 0.389 . . . . 0.0 111.352 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.625 ' O ' ' HG3' ' A' ' 59' ' ' MET . 7.0 tp -75.24 -29.54 60.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.246 0.546 . . . . 0.0 111.703 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' A' ' 61' ' ' LYS . 19.4 t0 -76.12 -28.19 57.37 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.643 -178.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.431 ' HB2' ' O ' ' A' ' 54' ' ' GLY . 7.2 mtt180 -75.24 -45.21 41.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.697 0.284 . . . . 0.0 111.554 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.886 ' HE2' HD21 ' A' ' 83' ' ' LEU . 0.9 OUTLIER -54.35 -54.32 42.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 112.077 -179.283 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.739 ' CE ' HD13 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -70.7 -22.72 62.42 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.517 -179.14 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.568 ' HB2' ' O ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -67.98 -60.91 2.14 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.236 178.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.03 -14.17 62.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.953 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.995 HD22 ' CD2' ' A' ' 65' ' ' LEU . 4.8 tt -64.05 -8.77 12.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.826 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.441 ' CB ' ' O ' ' A' ' 63' ' ' LEU . 3.7 t70 82.42 -60.29 0.17 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.963 0.411 . . . . 0.0 110.199 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.995 ' CD2' HD22 ' A' ' 63' ' ' LEU . 1.1 mt 67.65 -159.85 0.22 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.955 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 64.86 150.23 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.831 0.348 . . . . 0.0 110.757 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 3.7 p -57.02 89.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.104 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -124.63 -44.26 1.98 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.701 179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.66 37.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.443 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HB3' ' HB ' ' A' ' 29' ' ' THR . 0.6 OUTLIER 57.35 -171.36 0.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.608 0.242 . . . . 0.0 110.768 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 72' ' ' ASP . 0.8 OUTLIER -66.43 -146.79 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.396 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.627 ' HB3' ' O ' ' A' ' 71' ' ' LEU . 1.3 p30 170.79 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.221 0.534 . . . . 0.0 112.127 179.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.8 ' CZ ' ' HB1' ' B' ' 84' ' ' ALA . 0.3 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.698 -178.739 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.5 HE21 ' CB ' ' A' ' 78' ' ' ASN . 37.4 tp60 -66.41 -34.01 76.99 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.603 -178.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.919 ' O ' HD23 ' A' ' 79' ' ' LEU . 1.9 tt0 -45.14 -47.09 12.25 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 120.806 0.336 . . . . 0.0 110.188 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.536 ' HA ' ' HB2' ' A' ' 79' ' ' LEU . 1.8 t80 -70.98 -46.45 62.31 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.412 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.702 HD13 ' HA3' ' B' ' 81' ' ' GLY . 7.2 mt -56.81 -40.14 75.46 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.5 ' CB ' HE21 ' A' ' 74' ' ' GLN . 0.1 OUTLIER -76.44 -39.51 53.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.056 178.183 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.919 HD23 ' O ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -60.26 -58.22 9.44 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.526 179.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.637 HD11 HG12 ' B' ' 10' ' ' ILE . 0.0 OUTLIER -74.15 -46.08 45.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.706 178.82 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.707 ' HA3' HD13 ' B' ' 77' ' ' LEU . . . -54.27 -50.33 56.49 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 178.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.405 ' O ' HG23 ' A' ' 85' ' ' VAL . . . -51.41 -35.53 36.14 Favored Glycine 0 CA--C 1.52 0.356 0 C-N-CA 120.251 -0.976 . . . . 0.0 111.425 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.886 HD21 ' HE2' ' A' ' 59' ' ' MET . 11.3 mt -61.5 -43.9 98.04 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.88 0.371 . . . . 0.0 110.06 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.787 ' HB1' ' CZ ' ' B' ' 73' ' ' PHE . . . -55.29 -34.22 63.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.324 0.583 . . . . 0.0 110.942 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -84.17 -17.01 10.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.195 -179.682 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.502 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -116.16 13.64 15.77 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.764 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.435 ' N ' ' O ' ' A' ' 83' ' ' LEU . 0.5 OUTLIER -157.32 -42.87 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.263 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 84' ' ' ALA . 20.4 m-70 -75.86 147.67 38.9 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.378 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.35 78.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.919 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.477 ' CB ' ' CE2' ' B' ' 73' ' ' PHE . 74.9 m -145.99 -53.55 0.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.623 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.674 ' HB2' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -112.96 -44.97 3.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.743 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 85' ' ' VAL . 7.9 m -64.73 -27.23 42.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.317 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.7 mptt -96.29 24.66 5.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.09 27.04 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.282 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.705 ' HB1' ' CB ' ' A' ' 98' ' ' GLN . . . -137.43 60.83 28.52 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.286 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.458 ' HD3' ' N ' ' A' ' 95' ' ' ALA . 41.7 Cg_exo -58.53 -46.74 22.34 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.699 2.266 . . . . 0.0 112.859 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 96' ' ' PRO . 91.4 Cg_endo -80.93 -23.71 5.3 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.351 2.034 . . . . 0.0 112.633 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.705 ' CB ' ' HB1' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -54.55 105.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.07 -179.931 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -86.43 -176.34 5.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.953 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -87.6 130.46 34.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.824 179.979 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.836 0.35 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -99.87 110.78 60.31 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.881 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.03 -100.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.67 2.247 . . . . 0.0 112.319 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' THR . . . . . 0.629 HG23 ' HB2' ' B' ' 7' ' ' GLU . 0.0 OUTLIER -175.16 144.97 0.76 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.16 179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -44.87 -40.29 6.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.081 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.95 ' O ' HD12 ' B' ' 10' ' ' ILE . 1.6 m -70.07 -37.47 75.49 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.227 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.629 ' HB2' HG23 ' B' ' 4' ' ' THR . 0.0 OUTLIER -52.35 -39.67 61.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.028 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 74.7 mtt180 -77.44 -26.81 51.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.635 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' CYS . . . . . 0.594 ' HB3' HD22 ' A' ' 13' ' ' LEU . 81.7 m -72.34 -51.79 19.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.146 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ILE . . . . . 1.076 HG22 HD11 ' B' ' 14' ' ' ILE . 2.7 mp -52.89 -56.26 8.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.653 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.975 ' HA ' HD12 ' B' ' 14' ' ' ILE . 0.3 OUTLIER -52.34 -27.55 15.85 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' B' ' 16' ' ' VAL . 0.4 OUTLIER -65.89 -55.66 15.8 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.027 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' LEU . . . . . 1.032 ' O ' HG22 ' B' ' 16' ' ' VAL . 3.9 mm? -71.35 -27.65 63.51 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -178.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' ILE . . . . . 1.076 HD11 HG22 ' B' ' 10' ' ' ILE . 7.7 mt -67.31 -37.4 78.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.543 0.687 . . . . 0.0 110.851 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.11 -32.83 61.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.403 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 1.032 HG22 ' O ' ' B' ' 13' ' ' LEU . 22.9 m -52.64 -38.31 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.506 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.505 ' N ' HG23 ' B' ' 16' ' ' VAL . 4.5 t80 -77.48 -58.06 3.48 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 114.092 -1.413 . . . . 0.0 110.486 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' B' ' 14' ' ' ILE . 1.3 mm-40 -49.07 -35.85 16.94 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.05 -52.32 58.9 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.204 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' TYR . . . . . 0.884 ' HB3' HD21 ' B' ' 30' ' ' LEU . 2.8 m-85 -81.22 -47.38 13.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.768 0.794 . . . . 0.0 110.152 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.563 ' HB2' ' HG ' ' B' ' 30' ' ' LEU . . . -56.98 -20.92 26.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.897 -179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 18' ' ' GLN . . . -70.15 165.09 51.64 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.327 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mtmt 61.28 101.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.771 0.32 . . . . 0.0 110.847 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -162.14 -46.09 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.872 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 149.94 -37.88 0.93 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.51 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -177.3 -39.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.831 0.348 . . . . 0.0 110.918 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 2.5 p -57.6 147.76 26.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.0 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 30.7 m -112.43 55.7 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.175 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' B' ' 70' ' ' GLN . 20.9 p -133.91 172.77 12.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.294 0.569 . . . . 0.0 110.798 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.884 HD21 ' HB3' ' B' ' 20' ' ' TYR . 0.4 OUTLIER -114.41 -144.74 0.39 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.578 -179.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.541 ' H ' HD22 ' B' ' 30' ' ' LEU . 0.0 OUTLIER -160.65 138.01 9.28 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.615 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.74 -41.6 44.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.809 0.337 . . . . 0.0 111.045 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' THR . . . . . 0.736 ' O ' ' HB2' ' B' ' 36' ' ' LEU . 1.0 OUTLIER -71.86 -45.25 62.0 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.855 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.41 ' O ' ' CD2' ' B' ' 20' ' ' TYR . 3.6 mt-10 -57.61 -28.96 64.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.213 0.53 . . . . 0.0 109.952 179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' PHE . . . . . 0.456 ' CE2' ' CB ' ' B' ' 79' ' ' LEU . 0.1 OUTLIER -67.43 -33.01 74.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.83 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.736 ' HB2' ' O ' ' B' ' 33' ' ' THR . 3.5 mm? -51.0 -59.21 4.41 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.437 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . 0.593 ' O ' HG22 ' B' ' 41' ' ' THR . 68.9 m -54.2 -48.61 70.81 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.605 -1.18 . . . . 0.0 111.523 -178.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.516 ' HA ' HG22 ' B' ' 41' ' ' THR . 31.9 t80 -57.88 -27.42 63.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.858 0.361 . . . . 0.0 110.92 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' MET . . . . . 0.89 ' HG2' HG21 ' B' ' 47' ' ' THR . 0.0 OUTLIER -73.76 -58.19 3.47 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.209 -179.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 1.8 p30 -65.5 -19.32 65.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.051 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.943 HG23 ' HG2' ' B' ' 42' ' ' GLU . 13.3 t -95.98 -31.73 12.93 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 -178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' GLU . . . . . 0.943 ' HG2' HG23 ' B' ' 41' ' ' THR . 0.9 OUTLIER -129.25 14.54 6.16 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -177.775 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.776 HD12 ' CE ' ' B' ' 39' ' ' MET . 39.5 mt -161.87 41.47 0.14 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.575 ' HB1' ' HG3' ' B' ' 48' ' ' LYS . . . -75.64 -26.26 57.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.799 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.88 -7.6 36.23 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.036 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -112.28 -13.96 13.39 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.589 -179.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.89 HG21 ' HG2' ' B' ' 39' ' ' MET . 3.2 p -123.93 -17.52 6.26 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.575 ' HG3' ' HB1' ' B' ' 44' ' ' ALA . 24.8 mttm -47.24 126.52 9.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.943 0.401 . . . . 0.0 111.524 -179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 63.8 13.62 7.63 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.397 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.64 31.03 0.41 Allowed 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.772 0.32 . . . . 0.0 111.428 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 9.4 mmtm -48.76 -29.36 4.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.941 0.401 . . . . 0.0 110.761 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.733 ' HB3' HG23 ' B' ' 55' ' ' VAL . 0.6 OUTLIER -130.0 88.31 49.02 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.513 179.571 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -68.45 -1.61 7.69 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.934 2.422 . . . . 0.0 113.021 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . 0.421 ' O ' ' HB2' ' B' ' 58' ' ' ARG . . . -98.22 -2.24 58.0 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.893 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.777 HG12 HD22 ' B' ' 83' ' ' LEU . 32.0 t -84.44 -63.21 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.887 0.375 . . . . 0.0 111.332 -179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.629 HD12 ' SD ' ' B' ' 59' ' ' MET . 7.0 tp -75.36 -29.5 59.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.657 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . 0.571 ' O ' ' HB2' ' B' ' 61' ' ' LYS . 19.4 t0 -76.05 -28.25 57.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.666 -178.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' B' ' 54' ' ' GLY . 7.2 mtt180 -75.23 -45.19 41.85 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.744 0.307 . . . . 0.0 111.625 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' MET . . . . . 0.884 ' HE3' HD11 ' B' ' 83' ' ' LEU . 0.9 OUTLIER -54.28 -54.42 40.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.169 0.509 . . . . 0.0 112.112 -179.371 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . 0.731 ' CE ' HD13 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -70.62 -22.73 62.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.548 -179.124 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' B' ' 57' ' ' ASP . 0.0 OUTLIER -68.01 -60.93 2.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.916 0.388 . . . . 0.0 110.191 178.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -66.93 -14.26 62.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.933 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.992 HD22 ' CD2' ' B' ' 65' ' ' LEU . 4.8 tt -64.13 -8.67 12.95 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.792 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.439 ' CB ' ' O ' ' B' ' 63' ' ' LEU . 3.7 t70 82.37 -60.28 0.18 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.98 0.419 . . . . 0.0 110.19 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.992 ' CD2' HD22 ' B' ' 63' ' ' LEU . 1.1 mt 67.78 -159.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.978 179.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' B' ' 65' ' ' LEU . 64.0 m-20 64.87 150.22 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.86 0.362 . . . . 0.0 110.8 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 3.7 p -57.11 89.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.122 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -124.53 -44.26 1.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.791 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 177.64 37.22 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.499 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.42 ' HB3' ' HB ' ' B' ' 29' ' ' THR . 0.6 OUTLIER 57.38 -171.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.565 0.221 . . . . 0.0 110.786 -179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.628 ' O ' ' HB3' ' B' ' 72' ' ' ASP . 0.8 OUTLIER -66.46 -146.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 179.424 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' ASP . . . . . 0.628 ' HB3' ' O ' ' B' ' 71' ' ' LEU . 1.3 p30 170.72 -169.04 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.227 0.536 . . . . 0.0 112.147 179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.788 ' CB ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -70.15 -63.93 0.99 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.709 -178.785 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' GLN . . . . . 0.503 HE21 ' CB ' ' B' ' 78' ' ' ASN . 37.6 tp60 -66.35 -34.07 77.15 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.561 -178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.924 ' O ' HD23 ' B' ' 79' ' ' LEU . 1.9 tt0 -45.06 -47.2 11.85 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.861 0.362 . . . . 0.0 110.095 179.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.526 ' HA ' ' HB2' ' B' ' 79' ' ' LEU . 1.9 t80 -71.01 -46.4 62.27 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.356 179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . 0.707 HD13 ' HA3' ' A' ' 81' ' ' GLY . 7.1 mt -56.83 -40.14 75.48 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' ASN . . . . . 0.503 ' CB ' HE21 ' B' ' 74' ' ' GLN . 0.1 OUTLIER -76.39 -39.6 53.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.208 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.924 HD23 ' O ' ' B' ' 75' ' ' GLU . 0.1 OUTLIER -60.21 -58.23 9.39 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.559 179.905 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.654 HD11 HG12 ' A' ' 10' ' ' ILE . 0.0 OUTLIER -74.2 -46.09 45.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.655 178.865 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.702 ' HA3' HD13 ' A' ' 77' ' ' LEU . . . -54.38 -50.13 57.68 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 178.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.406 ' HA2' HG23 ' B' ' 85' ' ' VAL . . . -51.55 -35.43 37.07 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.257 -0.973 . . . . 0.0 111.433 178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.884 HD11 ' HE3' ' B' ' 59' ' ' MET . 11.3 mt -61.59 -43.94 97.92 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.878 0.371 . . . . 0.0 110.003 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.8 ' HB1' ' CZ ' ' A' ' 73' ' ' PHE . . . -55.12 -34.24 63.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.402 0.62 . . . . 0.0 110.94 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.788 HG13 ' CB ' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -84.32 -16.99 10.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.126 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . 0.509 ' O ' HG22 ' B' ' 55' ' ' VAL . . . -116.1 13.59 15.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.775 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' B' ' 83' ' ' LEU . 0.5 OUTLIER -157.29 -42.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.294 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.501 ' HB2' ' HA ' ' B' ' 84' ' ' ALA . 20.2 m-70 -75.96 147.78 38.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.96 0.41 . . . . 0.0 111.305 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -65.37 78.69 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.874 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' SER . . . . . 0.473 ' CB ' ' CE2' ' A' ' 73' ' ' PHE . 74.9 m -146.01 -53.57 0.26 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.534 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' PHE . . . . . 0.711 ' HB2' HG12 ' B' ' 85' ' ' VAL . 0.1 OUTLIER -112.99 -44.93 3.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.702 179.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.487 HG13 ' O ' ' B' ' 85' ' ' VAL . 8.1 m -64.75 -27.23 42.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -96.36 24.72 5.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.078 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' ALA . . . . . . . . . . . . . . . -160.05 27.0 0.17 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.333 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.705 ' HB1' ' CB ' ' B' ' 98' ' ' GLN . . . -137.51 60.95 28.69 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.77 0.319 . . . . 0.0 111.243 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' PRO . . . . . 0.458 ' HD3' ' N ' ' B' ' 95' ' ' ALA . 41.7 Cg_exo -58.67 -46.66 22.41 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.619 2.213 . . . . 0.0 112.81 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.452 ' HD2' ' N ' ' B' ' 96' ' ' PRO . 91.2 Cg_endo -80.96 -23.62 5.32 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.418 2.079 . . . . 0.0 112.607 -179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' GLN . . . . . 0.705 ' CB ' ' HB1' ' B' ' 95' ' ' ALA . 0.0 OUTLIER -54.64 105.46 0.16 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.019 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 3.3 mttm -86.37 -176.29 5.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.988 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' ARG . . . . . 0.411 ' HB3' ' CZ ' ' B' ' 100' ' ' ARG . 5.6 ptp180 -87.57 130.49 34.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.882 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' PHE . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.875 179.918 . . . . . . . . 0 0 . 1 stop_ save_