data_2mux_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 2mux _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.699 ' H ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 121.024 0.44 . . . . 0.0 109.856 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -60.43 -54.19 48.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.539 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.623 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -62.73 -51.5 66.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.725 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.623 ' N ' ' CG2' ' A' ' 19' ' ' THR . 55.9 t80 -55.75 -53.02 61.72 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.143 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.56 -48.45 79.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.287 178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -50.22 -43.55 52.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.246 178.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.4 mt-30 -56.73 -53.54 56.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.087 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.528 ' O ' ' CG2' ' A' ' 28' ' ' THR . 11.7 mt -43.29 -35.39 1.47 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 123.336 0.397 . . . . 0.0 110.779 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -76.42 -21.41 56.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.174 0.511 . . . . 0.0 109.79 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.664 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.8 tt0 -87.36 -58.49 2.56 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.506 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -59.18 -59.6 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.431 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.6 OUTLIER -82.65 -2.84 55.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 -178.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.42 25.02 59.99 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.531 HG21 ' H ' ' A' ' 32' ' ' ASP . 3.3 mm -69.28 159.78 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.131 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.467 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 17.2 m-20 -132.36 22.25 4.39 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.283 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.531 ' H ' HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -103.85 121.19 42.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.461 ' O ' ' OE1' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -82.07 -26.48 33.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.249 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -83.96 -46.75 11.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 0.0 111.151 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.426 HD13 ' N ' ' A' ' 35' ' ' ILE . 6.3 mm -66.8 -20.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.081 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.408 ' O ' ' N ' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -74.12 -63.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.064 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.461 ' OE1' ' O ' ' A' ' 33' ' ' THR . 7.1 pt20 -50.86 -25.0 3.98 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -75.47 -38.99 59.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.388 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.408 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -65.34 -19.15 65.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.895 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.475 HD12 ' CE2' ' A' ' 20' ' ' PHE . 12.2 tp -79.14 -52.99 7.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.603 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -51.81 -33.77 37.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -27.77 27.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.59 ' OG ' ' N ' ' A' ' 50' ' ' ALA . 3.6 m -80.51 -30.65 37.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.815 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 61.92 35.05 16.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.289 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.33 4.63 50.04 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.681 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.425 ' ND2' ' O ' ' A' ' 43' ' ' SER . 6.6 m-80 -93.8 130.96 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -84.76 -62.62 1.5 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.71 -178.013 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -52.75 -21.87 4.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.025 0.441 . . . . 0.0 110.289 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.685 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -81.49 -54.85 5.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.199 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.59 ' N ' ' OG ' ' A' ' 43' ' ' SER . . . -52.44 -36.75 55.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.421 ' CG2' HD12 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -63.26 -49.53 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.34 177.697 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.0 -44.13 82.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.785 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -60.55 -24.56 65.48 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.863 -0.735 . . . . 0.0 110.816 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 50' ' ' ALA . 68.6 mt -87.37 -53.57 4.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.744 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 12.9 t . . . . . 0 C--N 1.329 -0.32 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.358 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.448 ' N ' ' OD1' ' A' ' 101' ' ' ASP . 1.0 OUTLIER . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.075 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.611 ' CD1' ' C ' ' A' ' 102' ' ' LEU . 0.2 OUTLIER -56.12 -35.65 67.32 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.581 -179.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.453 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 2.1 tt0 -53.91 -19.51 4.66 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.441 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.1 ttt180 -86.54 -33.05 20.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.857 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.55 -53.97 49.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.159 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -47.33 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.352 0.596 . . . . 0.0 110.573 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.82 -57.34 7.56 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.158 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.59 -44.75 18.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.102 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.467 ' C ' ' N ' ' A' ' 111' ' ' ALA . 8.7 t -63.87 -44.43 93.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.218 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.483 ' CD2' ' O ' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -48.61 -19.02 0.3 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.467 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -86.45 -57.99 2.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.65 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -47.77 -18.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.307 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.435 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.627 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.414 ' CD ' ' N ' ' A' ' 126' ' ' GLU . 1.9 pp20? . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' A' ' 125' ' ' GLU . 1.8 tt0 -55.42 -53.26 58.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.862 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.51 -27.67 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.632 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 130' ' ' SER . . . -72.91 -84.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.619 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.544 ' C ' ' O ' ' A' ' 128' ' ' ALA . 2.6 mt -26.9 -39.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.77 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.59 ' N ' ' O ' ' A' ' 128' ' ' ALA . 9.1 m -62.43 -68.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.645 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -43.49 -25.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.677 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.527 ' O ' ' N ' ' A' ' 135' ' ' ALA . 41.7 t -75.42 -62.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.447 ' C ' ' O ' ' A' ' 132' ' ' VAL . 14.5 mt -37.55 -56.18 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 135' ' ' ALA . 39.9 tt0 -56.09 -41.21 74.83 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.875 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.527 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -36.4 -61.0 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -60.21 -43.34 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.12 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.462 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -81.03 -42.06 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.215 0.531 . . . . 0.0 110.853 -179.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.469 ' CE1' HD23 ' A' ' 40' ' ' LEU . 29.4 t80 -56.84 -56.86 16.17 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.564 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.0 mt -64.46 -39.91 94.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.105 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.62 -40.73 75.87 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.07 -47.5 80.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.056 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 28' ' ' THR . 14.7 mt -51.16 -53.57 33.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.179 0.514 . . . . 0.0 110.644 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.643 ' C ' ' HE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -60.07 -16.57 32.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.26 0.553 . . . . 0.0 109.593 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -82.08 -57.47 3.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.527 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -78.27 -46.81 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.365 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.527 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.0 t -92.35 -3.17 55.75 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.665 -177.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.57 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . 62.72 -7.6 0.25 Allowed Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.708 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.446 HG12 ' OG1' ' A' ' 28' ' ' THR . 41.1 mm -59.17 97.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 117.911 0.856 . . . . 0.0 110.301 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 29' ' ' GLY . 3.8 m-20 -83.06 36.56 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.134 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -106.91 85.56 2.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.9 0.381 . . . . 0.0 110.114 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -43.7 -37.05 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.019 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -47.22 83.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.656 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.464 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.7 mp -75.62 -33.08 25.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.657 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.41 ' CD2' HD23 ' A' ' 54' ' ' LEU . 5.8 mt -65.35 -63.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -51.3 -28.13 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.097 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -78.21 -39.43 40.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.84 82.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.048 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.599 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 tm? -67.93 -43.05 80.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.79 -40.26 20.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.577 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.478 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.5 t0 -87.3 -40.19 14.7 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.602 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -63.87 -24.29 67.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.682 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 1.4 p-10 50.35 42.15 25.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.558 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.64 -1.39 49.13 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.063 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.602 ' O ' ' OG ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -96.85 122.8 40.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 50' ' ' ALA . 21.6 tp -84.99 -61.79 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.248 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' A' ' 47' ' ' LEU . 5.3 mt-10 -42.73 -21.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -89.61 -39.3 13.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.618 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -67.38 -54.83 17.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.596 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 10.1 p -53.46 -53.16 26.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.596 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -52.54 -45.02 66.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.455 -1.248 . . . . 0.0 109.586 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.478 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -49.18 -27.81 3.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.636 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.2 mp -85.86 -52.42 5.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.737 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.6 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.479 -179.868 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.714 0.292 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.538 ' C ' ' N ' ' A' ' 104' ' ' ARG . 2.4 mm? -73.02 -46.43 52.1 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.118 0.485 . . . . 0.0 109.84 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -44.99 -20.11 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.538 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.2 ttt-85 -85.69 -45.79 11.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.116 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -53.97 -47.42 71.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.87 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.413 ' H ' HG12 ' A' ' 106' ' ' ILE . 8.2 mm -62.28 -57.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 121.668 0.747 . . . . 0.0 109.924 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -45.31 -44.02 11.2 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.055 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.31 -39.23 66.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.148 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.464 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.7 OUTLIER -73.49 -46.73 46.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.238 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -48.39 -17.89 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.464 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -87.99 -58.41 2.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.572 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -47.58 -24.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.929 179.364 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.857 0.361 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.4 -49.65 76.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.631 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.78 -30.33 69.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.521 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.48 73.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.541 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.8 mt -59.76 -58.21 8.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.587 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.91 -37.94 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.497 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.66 -56.65 18.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.533 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 4.1 t -44.38 -36.01 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.52 ' O ' ' C ' ' A' ' 134' ' ' GLU . 2.4 mp -67.69 -89.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.966 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.52 ' C ' ' O ' ' A' ' 133' ' ' LEU . 31.4 mt-10 -33.58 -49.72 0.31 Allowed 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.449 ' C ' ' O ' ' A' ' 134' ' ' GLU . . . -37.44 -69.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.479 ' O ' ' OG ' ' A' ' 136' ' ' SER . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.873 0.368 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -59.89 -55.09 38.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.622 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.601 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -68.51 -48.36 64.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.297 0.57 . . . . 0.0 110.313 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.601 ' N ' ' CG2' ' A' ' 19' ' ' THR . 40.0 t80 -47.35 -60.28 2.61 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.972 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.86 -52.07 65.64 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.956 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -45.14 -32.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.692 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -71.87 -48.8 43.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.882 179.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.502 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 1.9 mp -45.24 -25.67 0.4 Allowed 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.426 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -88.38 -24.39 23.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.766 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.692 ' N ' ' O ' ' A' ' 23' ' ' GLN . 5.6 tm-20 -86.84 -57.77 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.445 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.35 -59.68 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.113 -177.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.448 HG22 ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.5 -5.14 58.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.787 -179.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.35 32.65 76.01 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.209 -0.519 . . . . 0.0 111.893 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -88.25 153.58 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.66 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.589 ' N ' ' OD1' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -108.08 -54.57 2.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.907 -179.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.402 ' CB ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -41.24 101.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.353 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.3 m -66.7 -24.81 66.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.164 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -69.04 -51.71 36.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.756 0.312 . . . . 0.0 110.857 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.402 HD12 ' CB ' ' A' ' 32' ' ' ASP . 69.8 mt -53.21 -20.59 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 39' ' ' ALA . 4.6 mt -80.18 -60.66 2.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.725 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -43.38 -25.2 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.574 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.22 -39.87 32.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.004 179.349 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -63.18 -36.4 83.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.817 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.464 ' C ' ' CD2' ' A' ' 40' ' ' LEU . 7.0 tt -66.57 -40.45 88.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.005 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -52.83 -39.19 62.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.024 0.44 . . . . 0.0 109.891 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.4 m-20 -86.76 -30.0 21.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.699 ' HG ' ' N ' ' A' ' 46' ' ' ASN . 0.1 OUTLIER -79.38 -21.47 45.68 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.083 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 40' ' ' LEU . 36.3 m120 62.21 29.85 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.939 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.45 1.42 53.53 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.699 ' N ' ' HG ' ' A' ' 43' ' ' SER . 5.2 m-20 -88.07 130.65 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.257 . . . . 0.0 110.378 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.478 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -83.98 -63.39 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.242 -178.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -45.66 -22.4 0.17 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.42 0.629 . . . . 0.0 109.533 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.725 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -89.71 -41.17 12.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.316 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.47 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -63.23 -46.89 84.8 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.682 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 7.9 p -58.75 -59.12 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.682 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -50.07 -40.19 44.63 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.458 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -53.93 -32.84 54.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.161 179.096 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.47 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 5.4 mp -85.76 -51.95 6.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.354 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.112 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.9 t0 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.782 0.325 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.4 tt -71.86 -54.46 10.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.209 0.528 . . . . 0.0 110.292 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.4 tp60 -43.96 -17.96 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.599 ' N ' ' C ' ' A' ' 102' ' ' LEU . 3.6 tpt180 -86.69 -37.72 17.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.372 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -59.93 -38.75 83.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.206 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.06 -37.25 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.555 0.693 . . . . 0.0 110.023 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -56.87 14.09 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.123 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.535 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 12.2 tp -48.48 -53.94 16.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.116 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 105' ' ' ALA . 0.7 OUTLIER -57.69 -49.28 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.833 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.7 mt -48.32 -17.93 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 108' ' ' LEU . . . -79.33 -54.55 5.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.612 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.481 ' CD ' ' N ' ' A' ' 112' ' ' GLU . 0.3 OUTLIER -46.6 -23.13 0.35 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.903 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.742 0.306 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -58.31 -36.58 73.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.698 ' H ' HE21 ' A' ' 127' ' ' GLN . 0.0 OUTLIER -77.55 -51.02 11.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.748 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.83 -44.36 39.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.553 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.41 -62.1 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.508 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.27 -16.84 9.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.813 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.1 ttt-85 -76.03 -52.15 10.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.615 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 48.3 t -64.55 -52.93 48.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.406 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.69 -52.88 16.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.572 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -51.64 -52.1 50.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.402 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.37 -13.07 2.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.415 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.462 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.762 0.315 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -55.36 -44.98 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.53 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.676 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -69.25 -43.5 73.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.644 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.474 ' N ' HG23 ' A' ' 19' ' ' THR . 38.3 t80 -50.96 -58.15 6.76 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.431 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.47 -42.27 96.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.004 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.59 -41.29 41.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.677 ' N ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -60.31 -46.54 89.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.095 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.497 ' O ' ' CG2' ' A' ' 28' ' ' THR . 40.9 mt -50.35 -57.95 6.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 109.927 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.429 ' CG ' ' O ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.07 -17.31 38.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.209 0.528 . . . . 0.0 109.752 179.333 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -78.86 -48.77 14.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.714 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.554 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -89.86 -46.92 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.162 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.554 ' N ' HG12 ' A' ' 27' ' ' ILE . 2.8 t -87.39 -2.84 58.9 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.373 -177.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.06 32.44 71.07 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.698 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.429 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 40.3 mm -89.77 128.65 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.281 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -94.03 -47.94 6.46 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.304 -179.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -41.07 98.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.576 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -77.11 -39.95 47.63 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.732 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 34.2 mm -72.46 -21.26 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.399 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.496 ' O ' ' N ' ' A' ' 39' ' ' ALA . 87.8 mt -76.0 -63.51 1.3 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.271 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.04 -26.0 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -73.53 -37.45 65.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.632 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.585 ' O ' ' OD1' ' A' ' 42' ' ' ASP . . . -60.37 -42.6 96.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.732 179.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.587 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.68 -36.06 79.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.379 179.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -53.44 -41.15 65.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.025 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.7 ' OD1' ' CD2' ' A' ' 53' ' ' PHE . 7.1 p30 -87.25 -23.96 24.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.478 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.583 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.4 OUTLIER -77.52 -7.52 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.686 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.692 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 56.77 25.22 9.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.214 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.45 -5.87 52.3 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.58 ' O ' ' OG ' ' A' ' 43' ' ' SER . 5.8 m120 -84.39 131.6 34.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 49' ' ' LEU . 13.2 tp -83.25 -64.11 1.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.52 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.458 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.1 tt0 -42.34 -21.02 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.691 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -88.0 -45.84 9.86 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.844 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -55.2 -53.06 60.83 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.726 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 3.9 p -57.19 -62.86 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.558 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.726 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -45.24 -35.22 3.22 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.242 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.7 ' CD2' ' OD1' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -64.35 -30.37 71.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.141 179.027 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.568 ' N ' ' O ' ' A' ' 51' ' ' VAL . 9.3 mt -87.87 -43.83 11.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.387 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.2 t . . . . . 0 C--N 1.33 -0.248 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.004 -179.626 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.6 t70 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.705 0.288 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 104' ' ' ARG . 1.2 tp -71.37 -53.67 13.35 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.15 0.5 . . . . 0.0 110.696 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.421 ' C ' ' O ' ' A' ' 102' ' ' LEU . 26.1 tp60 -43.83 -18.6 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.588 ' N ' ' O ' ' A' ' 102' ' ' LEU . 1.4 mtp180 -86.64 -38.96 16.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.609 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -54.28 -57.78 9.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.398 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.447 ' CD1' ' H ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.64 -57.22 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.756 0.788 . . . . 0.0 109.868 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -44.09 -39.61 4.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.343 -1.299 . . . . 0.0 110.128 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.15 -44.23 92.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.923 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.45 ' C ' ' N ' ' A' ' 111' ' ' ALA . 2.7 t -68.4 -48.34 64.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.51 -17.25 0.76 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.45 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -80.19 -58.85 2.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.039 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -46.82 -25.81 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.864 179.186 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.797 0.332 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -39.54 74.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.221 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.513 ' C ' ' CD ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -71.18 -35.71 71.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.907 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.4 -70.98 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.364 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.4 mt -44.68 -39.14 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.4 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 t -55.69 -56.69 17.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.412 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 27.7 ttt-85 -52.3 -51.69 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.05 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.592 ' O ' ' OG ' ' A' ' 136' ' ' SER . 33.2 t -47.46 -71.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.162 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.513 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.1 OUTLIER -30.03 -68.78 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.317 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.657 ' C ' ' H ' ' A' ' 136' ' ' SER . 29.2 tt0 -48.29 -59.85 3.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.717 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.18 4.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.694 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.657 ' H ' ' C ' ' A' ' 134' ' ' GLU . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.658 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.653 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 8.6 mp0 . . . . . 0 N--CA 1.457 -0.109 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -64.19 -56.52 14.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.191 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.606 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -75.53 -47.99 24.46 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.331 0.586 . . . . 0.0 110.533 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.606 ' N ' ' CG2' ' A' ' 19' ' ' THR . 61.4 t80 -46.79 -50.56 18.09 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.204 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.0 mt -69.33 -52.02 31.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.157 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -45.17 -37.9 4.85 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.635 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.3 mp0 -61.63 -55.72 27.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.881 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.446 ' O ' HG23 ' A' ' 28' ' ' THR . 9.0 mt -45.82 -21.87 0.15 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.256 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -87.9 -23.4 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.137 179.275 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.635 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.6 tt0 -87.53 -58.22 2.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.415 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.82 -59.89 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.444 -177.475 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -84.59 -5.51 59.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 -179.278 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.75 32.6 74.37 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.204 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.477 ' CG2' ' N ' ' A' ' 31' ' ' ASN . 4.4 mm -89.77 161.23 2.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.963 0.382 . . . . 0.0 110.986 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.477 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 23.5 m-20 -125.15 -21.13 4.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.524 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.2 124.68 23.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.532 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m -82.89 -21.96 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.351 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -43.0 19.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.644 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 62.0 mt -60.85 -43.9 96.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.913 0.387 . . . . 0.0 110.459 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' ALA . 75.9 mt -70.26 -56.78 5.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 0.4 OUTLIER -45.59 -27.07 0.69 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.822 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -71.43 -39.55 70.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.135 178.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.55 -25.44 65.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.838 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.618 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 1.2 tm? -72.64 -46.38 54.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.104 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.483 ' N ' HD11 ' A' ' 40' ' ' LEU . 19.8 mmmt -58.64 -31.77 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.658 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.86 -48.33 8.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.607 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 44' ' ' ASN . 88.8 p -63.61 -5.91 4.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.679 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.588 ' OD1' ' O ' ' A' ' 44' ' ' ASN . 5.6 p30 59.51 28.6 18.03 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.28 -11.65 54.92 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.687 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.56 ' OD1' ' OD1' ' A' ' 44' ' ' ASN . 10.8 m120 -85.31 131.88 34.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.054 0.427 . . . . 0.0 110.253 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 50' ' ' ALA . 65.7 tp -81.71 -61.29 1.97 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.211 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.4 mt-10 -40.89 -25.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.055 0.455 . . . . 0.0 109.81 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.707 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.3 mm? -90.05 -35.24 15.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.59 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -63.79 -52.2 61.33 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.632 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 7.5 p -56.64 -56.48 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.632 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -52.71 -36.17 56.92 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.462 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -54.19 -31.66 53.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.918 178.922 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.545 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -78.68 -55.36 5.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.222 0 CA-C-O 121.223 0.535 . . . . 0.0 109.687 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 p30 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.785 0.326 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 105' ' ' ALA . 5.1 tt -73.02 -50.08 25.13 Favored 'General case' 0 CA--C 1.51 -0.561 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.1 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -46.01 -20.12 0.08 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.533 ' N ' ' C ' ' A' ' 102' ' ' LEU . 0.8 OUTLIER -87.1 -31.53 20.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.436 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.611 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.1 -57.29 13.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.259 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.47 HD12 ' N ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -74.05 -34.1 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.15 -179.308 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.47 ' N ' HD12 ' A' ' 106' ' ' ILE . . . -61.51 -58.22 9.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.71 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -47.27 -44.79 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.781 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.488 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -61.27 -46.2 91.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.056 179.542 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.51 -18.54 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.488 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -82.3 -55.47 4.5 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.533 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -45.95 -22.72 0.22 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.45 ' N ' ' C ' ' A' ' 111' ' ' ALA . 19.1 m . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.142 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.7 0.286 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.84 -39.8 62.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.432 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -68.94 -34.08 74.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.68 -70.38 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.768 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.0 pp -39.49 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.798 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.1 m -72.43 -78.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.899 0.381 . . . . 0.0 110.89 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.583 ' CA ' ' HE ' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -25.74 -56.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.324 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.74 ' CG1' ' H ' ' A' ' 133' ' ' LEU . 7.2 p -57.72 -69.72 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.345 -179.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.74 ' H ' ' CG1' ' A' ' 132' ' ' VAL . 0.5 OUTLIER -42.34 -54.19 3.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.811 0.338 . . . . 0.0 110.654 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -41.18 -51.5 3.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.598 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.6 -23.58 59.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 133' ' ' LEU . 74.6 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 . . . . . 0 CA--C 1.523 -0.061 0 CA-C-O 120.763 0.316 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -46.65 -50.95 16.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.397 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.576 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -72.6 -49.33 32.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.194 0.521 . . . . 0.0 110.872 -179.62 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.576 ' N ' ' CG2' ' A' ' 19' ' ' THR . 35.1 t80 -46.46 -58.91 3.32 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.9 mt -66.26 -49.84 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.217 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -45.54 -40.35 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 26' ' ' GLU . 13.2 mm-40 -61.46 -50.09 74.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.765 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.448 ' O ' ' CG2' ' A' ' 28' ' ' THR . 29.9 mt -44.28 -30.95 0.89 Allowed 'General case' 0 C--O 1.226 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.132 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.49 ' CD ' ' C ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -84.59 -18.99 33.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.08 0.467 . . . . 0.0 110.031 179.232 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.674 ' N ' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -87.4 -55.03 3.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.674 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.437 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -62.27 -59.58 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -177.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.448 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -89.15 -3.72 58.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.577 -178.088 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.43 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 66.08 32.68 83.15 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.304 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.404 HG12 ' OG1' ' A' ' 28' ' ' THR . 39.5 mm -106.97 107.48 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 117.449 0.625 . . . . 0.0 110.945 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.659 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -79.91 -20.11 46.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.678 -179.474 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -44.51 84.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.224 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.659 ' N ' ' O ' ' A' ' 31' ' ' ASN . 8.6 t -51.79 -24.47 6.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.866 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.473 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.67 -40.65 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.187 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.473 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 10.7 mt -75.36 -29.41 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.086 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.479 HD22 ' N ' ' A' ' 36' ' ' LEU . 3.2 mt -70.2 -44.81 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.527 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.422 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 2.7 pt20 -64.19 -28.75 69.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.386 . . . . 0.0 110.147 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 46.6 tt0 -79.59 -38.29 34.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.05 69.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.503 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.62 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -77.06 -40.33 46.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.127 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.485 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.64 -35.64 70.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.632 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.7 OUTLIER -86.09 -46.23 10.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.034 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.623 ' O ' ' N ' ' A' ' 45' ' ' GLY . 5.8 m -66.26 18.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.962 0.41 . . . . 0.0 111.01 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.723 HD22 ' ND2' ' A' ' 46' ' ' ASN . 0.8 OUTLIER 31.77 28.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.108 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.623 ' N ' ' O ' ' A' ' 43' ' ' SER . . . 97.5 26.53 9.89 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.945 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.723 ' ND2' HD22 ' A' ' 44' ' ' ASN . 12.7 m-80 -108.68 131.0 55.34 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -78.56 -63.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.728 -177.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.424 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 52.4 tt0 -49.13 -20.83 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.732 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.1 mm? -89.44 -52.57 4.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.486 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.551 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -53.81 -47.77 70.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.629 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 6.5 p -62.96 -50.71 78.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.119 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.629 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -60.33 -28.72 68.37 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.669 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.482 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.7 OUTLIER -61.91 -37.16 83.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.048 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.551 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -71.4 -57.62 4.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.936 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.817 0.341 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.649 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.3 mt -66.67 -51.84 51.61 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.012 0.434 . . . . 0.0 110.693 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 102' ' ' LEU . 0.7 OUTLIER -43.82 -18.85 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.6 ' N ' ' O ' ' A' ' 102' ' ' LEU . 3.5 ttp180 -86.76 -35.45 19.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.166 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.649 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -67.39 -47.99 68.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.117 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.83 -32.81 59.67 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.214 0.531 . . . . 0.0 110.451 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.81 -52.6 23.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.451 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 63.1 tp -46.33 -53.0 11.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.644 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.483 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER -63.79 -46.68 84.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.421 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.04 -17.46 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.483 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -86.95 -58.42 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.782 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -46.23 -22.4 0.23 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.86 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.429 ' N ' ' C ' ' A' ' 111' ' ' ALA . 8.6 t . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.502 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.789 0.328 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.03 -53.12 42.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.74 -39.26 90.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.543 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -63.16 -69.37 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.484 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 128' ' ' ALA . 5.0 mm -37.86 -48.34 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.696 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -60.72 2.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 131' ' ' ARG . 3.9 mmt180 -59.08 -55.77 30.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' A' ' 135' ' ' ALA . 82.9 t -48.02 -66.39 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.425 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.469 ' C ' ' O ' ' A' ' 132' ' ' VAL . 5.3 tt -34.57 -48.87 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.631 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.551 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -62.51 -30.89 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.692 -179.915 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -46.8 -32.4 3.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.385 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.603 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -69.37 -49.83 51.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.461 0.648 . . . . 0.0 110.081 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.603 ' N ' ' CG2' ' A' ' 19' ' ' THR . 74.9 t80 -60.1 -49.52 77.31 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.604 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -39.55 89.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.16 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -59.25 -39.37 82.63 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.472 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.613 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.9 mm100 -56.83 -51.64 68.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.138 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.493 ' O ' ' CG2' ' A' ' 28' ' ' THR . 4.5 mt -45.75 -41.26 10.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.332 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.661 ' NH2' ' OE1' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -69.7 -18.45 63.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.717 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.661 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 1.3 tp10 -85.89 -58.43 2.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -64.43 -59.41 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.493 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -83.24 -2.91 56.77 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.501 -178.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 62.7 20.23 61.54 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.032 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.537 ' CG2' ' N ' ' A' ' 31' ' ' ASN . 9.1 mm -65.62 160.36 3.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 117.094 0.447 . . . . 0.0 110.628 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.537 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 5.6 t-20 -117.12 -56.92 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.298 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -48.53 111.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.621 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.2 p -71.99 -19.88 61.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.728 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -70.65 -43.08 69.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.594 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.9 mt -62.05 -40.85 88.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.554 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 39' ' ' ALA . 16.3 mt -60.45 -62.1 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.451 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -43.41 -28.05 0.32 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.404 ' N ' ' C ' ' A' ' 36' ' ' LEU . 2.1 tp60 -76.09 -38.96 56.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.854 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.558 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.42 -38.07 84.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.075 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.612 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -62.29 -37.26 84.85 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.405 ' HB2' ' HZ3' ' A' ' 41' ' ' LYS . 0.1 OUTLIER -59.9 -43.38 94.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.067 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -78.67 -46.07 19.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.147 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.6 p -66.63 -31.57 72.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.307 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 67.3 47.08 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.728 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.473 ' H ' HD21 ' A' ' 40' ' ' LEU . . . 94.15 -14.33 65.52 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.02 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -80.12 124.94 29.21 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 49' ' ' LEU . 32.8 tp -85.02 -62.7 1.48 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.324 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' A' ' 47' ' ' LEU . 3.7 tt0 -42.44 -20.87 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.635 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 4.0 mm? -86.3 -50.19 7.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.608 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -58.2 -56.82 17.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.647 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 3.7 p -49.67 -46.89 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.647 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -60.08 -36.29 77.04 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.401 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -64.39 -36.13 83.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.253 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.484 ' N ' HD21 ' A' ' 54' ' ' LEU . 4.4 mm? -69.34 -57.49 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.179 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.9 t . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.391 179.837 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.594 ' OD2' ' NH2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.749 0.309 . . . . 0.0 110.573 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.576 ' CD1' ' C ' ' A' ' 102' ' ' LEU . 0.2 OUTLIER -60.57 -35.45 76.09 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 120.53 -0.468 . . . . 0.0 109.793 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.461 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.6 OUTLIER -56.25 -18.69 11.18 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.594 ' NH2' ' OD2' ' A' ' 101' ' ' ASP . 0.4 OUTLIER -82.38 -37.91 24.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.652 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.82 -49.02 76.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.98 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.505 HG22 HD11 ' A' ' 106' ' ' ILE . 1.3 mm -62.25 -40.95 89.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 109.75 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.0 -48.15 76.41 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.526 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.2 tp -55.89 -34.51 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.824 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.462 ' C ' ' N ' ' A' ' 111' ' ' ALA . 58.2 m -78.07 -49.69 13.48 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.575 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.06 -18.29 0.18 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.462 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.86 -58.25 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.457 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -46.25 -26.29 0.77 Allowed 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.466 ' N ' ' HG3' ' A' ' 112' ' ' GLU . 35.9 t . . . . . 0 C--N 1.322 -0.612 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.987 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.8 0.333 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 130' ' ' SER . 1.5 tt0 -53.26 -34.22 56.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.598 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.497 ' O ' ' OG ' ' A' ' 130' ' ' SER . 16.6 tt0 -65.91 -55.86 14.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.783 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -45.16 -64.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.446 ' N ' HD13 ' A' ' 129' ' ' ILE . 1.6 mp -43.9 -39.36 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.525 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.31 -44.27 83.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -50.33 -36.16 30.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.579 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.9 t -75.37 -62.91 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.49 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.9 mt -44.6 -42.94 7.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -51.57 56.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -74.84 5.61 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.018 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.436 ' HG2' ' N ' ' A' ' 18' ' ' GLN . 2.4 pt20 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.882 0.373 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.436 ' N ' ' HG2' ' A' ' 17' ' ' GLN . 5.1 mm-40 -47.13 -56.04 7.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.451 HG22 ' N ' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -72.54 -40.43 66.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.159 0.504 . . . . 0.0 110.326 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.451 ' N ' HG22 ' A' ' 19' ' ' THR . 36.7 t80 -45.47 -63.64 0.91 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.809 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.8 mt -55.97 -45.12 79.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.253 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 3.4 t-20 -48.56 -43.69 35.85 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.461 0.648 . . . . 0.0 109.43 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.734 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.5 mm100 -60.64 -55.79 29.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.438 ' HB3' ' CD1' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -43.8 -19.3 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.768 179.612 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -85.31 -25.29 27.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.734 ' N ' ' O ' ' A' ' 23' ' ' GLN . 15.0 tt0 -87.06 -58.14 2.7 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.378 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.748 ' CD1' ' H ' ' A' ' 27' ' ' ILE . 2.4 mp -53.54 -60.7 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -88.53 -3.12 58.87 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.663 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.13 32.89 62.59 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.532 HG21 ' H ' ' A' ' 32' ' ' ASP . 27.9 mm -81.58 162.16 3.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.191 0.52 . . . . 0.0 111.725 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.425 ' N ' HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -151.27 33.66 0.58 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.525 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.532 ' H ' HG21 ' A' ' 30' ' ' ILE . 24.6 m-20 -111.6 142.81 43.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.325 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 m -83.03 -39.32 21.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.666 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -78.92 -52.05 8.82 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.454 ' H ' HG12 ' A' ' 35' ' ' ILE . 8.1 mm -57.11 -25.17 22.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -83.69 -26.68 29.61 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.516 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -81.64 -18.35 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -85.16 -32.24 22.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.513 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.421 ' O ' ' N ' ' A' ' 43' ' ' SER . . . -74.12 -50.19 20.54 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.93 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.0 -41.41 83.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.797 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -61.95 -36.38 81.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.165 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.577 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 1.1 t0 -86.6 -20.16 28.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.152 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.556 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -82.96 -30.36 28.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.898 -179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.498 ' N ' ' ND2' ' A' ' 44' ' ' ASN . 0.2 OUTLIER 72.9 34.21 1.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.977 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.49 2.15 68.06 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.556 ' O ' ' OG ' ' A' ' 43' ' ' SER . 3.0 m120 -96.61 126.06 41.52 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -79.75 -64.02 1.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.54 -177.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.446 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 31.8 tt0 -43.2 -21.44 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.705 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.0 mm? -88.05 -43.83 11.41 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.689 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.567 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -60.21 -55.13 37.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.688 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 7.4 p -54.53 -57.34 6.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 121.856 0.836 . . . . 0.0 109.063 178.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.688 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -49.86 -42.09 46.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.875 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -52.09 -32.32 34.49 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.626 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.567 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.8 mp -74.44 -57.74 3.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.128 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.348 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.532 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 6.1 t70 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 120.893 0.378 . . . . 0.0 110.421 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.63 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.6 OUTLIER -57.56 -47.87 80.88 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.145 0.497 . . . . 0.0 110.051 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -44.98 -19.8 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.566 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.3 ttt180 -82.76 -37.86 24.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.768 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.63 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.9 -54.77 40.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.56 -36.41 77.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 121.371 0.605 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.9 94.77 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.44 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.21 -45.97 86.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.408 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.9 OUTLIER -66.83 -55.88 12.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.277 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 18.4 tp -47.62 -17.9 0.12 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.524 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -76.27 -58.29 3.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.597 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -49.9 -21.28 1.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.868 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.723 0.297 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.8 -35.34 69.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.882 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -81.62 -35.48 30.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.676 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.09 -39.18 72.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.876 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.1 mm -78.0 -40.28 26.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.821 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.5 t -73.7 -22.02 60.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -56.9 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.583 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.2 p -56.92 -37.54 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.596 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -63.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.456 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 134' ' ' GLU . 0.4 OUTLIER -45.63 -50.51 13.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.439 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.14 -42.52 66.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.675 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.458 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.721 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 1.3 pm0 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.754 0.311 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.662 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 77.4 mt-30 -53.82 -41.47 67.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.517 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -81.06 -44.78 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.148 0.499 . . . . 0.0 110.564 -179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CD1' ' CD1' ' A' ' 40' ' ' LEU . 12.4 t80 -48.79 -60.68 2.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.84 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.1 mt -58.58 -40.71 83.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -54.18 -40.62 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.646 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.8 mm100 -60.05 -52.96 63.15 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.475 ' HA ' ' CD1' ' A' ' 27' ' ' ILE . 10.4 mt -44.31 -22.4 0.07 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.208 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.444 ' N ' ' C ' ' A' ' 23' ' ' GLN . 19.3 ttm-85 -86.95 -27.2 23.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.257 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 23' ' ' GLN . 26.4 mt-10 -88.49 -55.75 3.59 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.414 1.265 . . . . 0.0 114.414 -177.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.475 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.52 -60.02 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.615 -176.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER -84.82 -4.52 59.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.693 -178.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.27 32.49 67.9 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.834 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.443 HG22 HD12 ' A' ' 30' ' ' ILE . 3.5 mt -98.96 145.47 10.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.77 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 33' ' ' THR . 15.0 m-20 -97.33 -44.46 6.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.51 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.82 88.45 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.554 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.575 ' N ' ' O ' ' A' ' 31' ' ' ASN . 19.1 p -60.92 -23.88 65.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.45 -44.75 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.05 0.453 . . . . 0.0 110.237 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.4 mt -73.87 -31.2 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.498 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.7 mt -70.59 -63.57 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.808 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.532 ' OE1' ' N ' ' A' ' 38' ' ' GLN . 0.0 OUTLIER -47.39 -35.48 8.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.103 0.478 . . . . 0.0 110.369 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 37' ' ' GLN . 3.5 tp60 -73.34 -34.15 65.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.959 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 43' ' ' SER . . . -62.64 -44.56 95.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.683 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.486 ' CD1' ' CD1' ' A' ' 20' ' ' PHE . 3.2 tt -62.89 -44.46 96.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.952 0.406 . . . . 0.0 110.579 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' CB ' ' HZ1' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -56.69 -33.55 66.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 m-20 -87.18 -23.35 24.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.888 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 0.3 OUTLIER -88.96 -7.91 55.13 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.026 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.401 ' N ' HD21 ' A' ' 44' ' ' ASN . 3.0 m120 66.27 21.84 10.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.313 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.47 14.54 27.56 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.731 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.535 ' OD1' ' O ' ' A' ' 43' ' ' SER . 4.8 m120 -107.95 127.39 53.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.469 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -68.78 -62.81 1.23 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.4 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 50.5 mt-10 -44.54 -21.69 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.012 0.434 . . . . 0.0 110.702 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.716 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -90.22 -39.44 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.684 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.525 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -64.45 -50.89 65.74 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.6 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 7.6 p -59.63 -49.43 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.368 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.6 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -61.53 -33.94 74.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.528 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -59.11 -28.35 66.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.287 179.312 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.7 mp -80.53 -55.11 5.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.436 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.1 t . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.008 0.433 . . . . 0.0 110.126 179.528 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 t70 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.796 0.331 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.9 OUTLIER -77.19 -52.98 8.31 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.045 0.45 . . . . 0.0 110.669 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.435 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.3 mp0 -44.25 -18.82 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -85.97 -39.11 17.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.451 -1.249 . . . . 0.0 109.99 179.548 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -50.33 -57.39 8.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.521 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 103' ' ' GLN . 0.1 OUTLIER -65.31 -54.68 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-O 121.566 0.698 . . . . 0.0 110.332 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.51 -60.23 1.83 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.51 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -47.87 -40.11 20.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.497 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.1 OUTLIER -68.56 -45.33 72.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.473 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mp -48.46 -19.05 0.28 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.497 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.21 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.226 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -49.39 -19.61 0.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.016 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.414 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.672 0.272 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -53.53 45.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.453 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.447 ' HG3' ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -64.51 -35.98 82.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.161 179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.473 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -59.22 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.175 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.473 ' C ' ' O ' ' A' ' 128' ' ' ALA . 9.1 mm -35.76 -40.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.318 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 30.8 t -66.49 -69.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.497 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -42.15 -48.68 4.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.653 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 13.7 t -57.22 -62.39 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.673 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.38 -35.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.461 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -61.97 -49.05 77.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.535 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.07 -17.4 25.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.738 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.6 m . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.499 179.937 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.458 ' OE1' ' CD1' ' A' ' 21' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.226 -0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.18 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -43.74 -58.33 2.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.48 -34.43 67.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.451 0.643 . . . . 0.0 110.648 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.479 ' CZ ' HD11 ' A' ' 40' ' ' LEU . 1.1 t80 -50.72 -60.61 2.87 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.273 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.458 ' CD1' ' OE1' ' A' ' 17' ' ' GLN . 2.0 mt -66.24 -47.19 74.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.117 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -48.71 -42.75 36.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.144 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.571 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -63.16 -53.64 50.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.001 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.524 ' O ' ' CG2' ' A' ' 28' ' ' THR . 26.4 mt -47.91 -26.1 1.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.4 ttm105 -85.38 -19.14 31.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.447 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 23' ' ' GLN . 7.0 tt0 -86.6 -58.53 2.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.597 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -67.24 -54.8 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.548 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.597 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.3 t -87.75 -2.57 58.7 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.588 -176.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 60.83 4.66 4.48 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.622 -0.717 . . . . 0.0 113.67 177.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.474 HG21 ' H ' ' A' ' 32' ' ' ASP . 40.8 mm -65.99 125.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 118.077 0.939 . . . . 0.0 109.961 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.479 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -105.57 30.78 5.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.234 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.474 ' H ' HG21 ' A' ' 30' ' ' ILE . 14.9 m-20 -100.7 88.85 3.71 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.4 m -53.84 -30.41 45.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.895 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -67.7 -51.89 44.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.498 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.81 -22.25 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.413 ' O ' ' N ' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -73.71 -63.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.584 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -51.8 -27.53 12.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -73.82 -25.27 60.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.456 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.481 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -73.97 -35.37 64.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.006 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.479 HD11 ' CZ ' ' A' ' 20' ' ' PHE . 14.1 tp -67.36 -47.75 69.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.399 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -59.78 -41.78 91.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.359 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.469 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -86.34 -15.65 39.85 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.116 -179.391 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.591 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 1.7 t -76.8 -31.21 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.483 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.662 ' OD1' ' ND2' ' A' ' 46' ' ' ASN . 0.5 OUTLIER 84.51 13.51 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.931 -179.529 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.21 13.37 31.26 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.112 -0.565 . . . . 0.0 112.388 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.662 ' ND2' ' OD1' ' A' ' 44' ' ' ASN . 51.0 m-20 -107.92 130.67 55.01 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' A' ' 50' ' ' ALA . 53.7 tp -86.02 -64.76 1.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -177.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -46.44 -26.33 0.83 Allowed 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.678 0.751 . . . . 0.0 109.276 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.573 ' CD2' ' C ' ' A' ' 49' ' ' LEU . 0.1 OUTLIER -87.19 -29.85 21.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.387 179.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 53' ' ' PHE . . . -74.26 -58.37 3.34 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.478 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 14.5 p -43.63 -40.07 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.478 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -67.64 -27.89 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.252 -1.34 . . . . 0.0 110.392 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.696 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -60.0 -28.92 68.1 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.452 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.56 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 5.6 mp -80.62 -53.51 6.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.299 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.025 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 12.3 m-20 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.873 0.368 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.611 ' CD1' ' N ' ' A' ' 103' ' ' GLN . 4.2 pp -56.03 -46.11 78.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.086 0.469 . . . . 0.0 110.16 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.611 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.14 -19.71 0.08 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.528 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.534 ' N ' ' C ' ' A' ' 102' ' ' LEU . 20.8 ttp85 -85.09 -37.04 20.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.968 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -62.95 -45.3 93.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.314 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.558 ' CD1' ' N ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -69.44 -32.66 53.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-O 121.236 0.541 . . . . 0.0 110.537 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.36 -60.29 3.58 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.237 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 30.7 mt -47.24 -42.58 20.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.521 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.454 ' C ' ' N ' ' A' ' 111' ' ' ALA . 81.2 p -72.69 -41.77 64.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.661 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 mt -48.2 -19.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.454 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -89.44 -58.59 2.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.24 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -48.21 -21.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.563 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.402 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.879 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.789 0.328 . . . . 0.0 110.869 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -51.24 -48.74 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.7 -25.89 67.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.774 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.45 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.75 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.6 mp -49.35 -33.07 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.845 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' CB ' ' A' ' 134' ' ' GLU . 0.0 OUTLIER -68.73 -25.3 64.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.747 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -85.26 -49.59 8.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -54.98 -40.99 56.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.503 ' N ' ' CG1' ' A' ' 132' ' ' VAL . 4.1 tp -80.55 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.544 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 130' ' ' SER . 1.4 tt0 -38.0 -31.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.362 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . -78.62 -52.5 8.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.57 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.796 ' NE2' ' H ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.069 0 CA-C-O 120.75 0.309 . . . . 0.0 110.728 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.65 ' N ' ' OE1' ' A' ' 18' ' ' GLN . 3.8 mp0 -61.52 -58.28 8.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.663 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -73.78 -34.92 64.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.446 0.641 . . . . 0.0 110.213 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.479 ' CE1' HD23 ' A' ' 40' ' ' LEU . 2.1 t80 -51.89 -60.77 2.79 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.91 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.9 mt -67.72 -31.99 72.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.983 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.455 ' HB3' HE22 ' A' ' 23' ' ' GLN . 1.6 t30 -60.11 -41.87 93.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 0.0 110.147 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.747 ' NE2' ' N ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -67.32 -50.18 61.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.109 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.492 ' O ' ' CG2' ' A' ' 28' ' ' THR . 12.6 mt -45.57 -31.82 2.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.33 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.1 ttt-85 -87.61 -20.62 26.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.908 0.385 . . . . 0.0 110.492 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.535 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.1 tt0 -87.58 -58.08 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.473 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -62.76 -44.59 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.196 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.492 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 1.4 t -99.64 -2.68 34.89 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.676 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 63.65 19.33 62.62 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.453 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -79.12 113.56 18.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.541 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -76.75 -50.77 12.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.788 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.7 m-20 -41.43 103.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.308 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.6 t -71.76 -27.22 62.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.737 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -59.64 -41.71 91.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.518 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 35' ' ' ILE . 12.8 mm -68.38 -45.84 81.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.705 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.645 ' O ' ' N ' ' A' ' 39' ' ' ALA . 18.2 mt -63.98 -60.75 2.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.189 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 36' ' ' LEU . 4.9 mm-40 -43.46 -29.2 0.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.421 ' N ' ' C ' ' A' ' 36' ' ' LEU . 3.1 tt0 -78.87 -32.28 45.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.083 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.645 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -69.64 -33.79 73.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.514 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 3.0 tm? -66.12 -38.28 87.79 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.093 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -71.13 -42.61 68.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.97 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.56 -24.13 25.57 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.861 0.363 . . . . 0.0 111.481 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.593 ' OG ' ' O ' ' A' ' 39' ' ' ALA . 6.9 p -62.82 -30.3 71.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.778 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.2 t-20 83.66 14.28 0.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.01 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.84 4.97 48.24 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.06 -0.59 . . . . 0.0 111.642 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' HD21 ' A' ' 49' ' ' LEU . 2.9 m120 -100.74 130.16 46.74 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.655 ' O ' ' N ' ' A' ' 50' ' ' ALA . 2.1 tt -85.75 -62.84 1.43 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.879 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.518 ' O ' ' CG1' ' A' ' 51' ' ' VAL . 3.5 mt-10 -41.4 -38.21 1.19 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.093 0.473 . . . . 0.0 110.393 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -81.13 -26.56 36.04 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.235 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.655 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -69.63 -58.46 3.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.518 ' CG1' ' O ' ' A' ' 48' ' ' GLU . 1.6 p -44.41 -44.96 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.74 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 177.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.73 -28.62 69.55 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.282 -1.781 . . . . 0.0 110.361 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.641 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -64.32 -29.51 70.59 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.509 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.478 ' CD2' ' N ' ' A' ' 54' ' ' LEU . 3.1 mm? -75.66 -57.59 3.79 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.287 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.1 t . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.683 179.605 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.1 t0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.916 0.389 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.642 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.8 OUTLIER -64.86 -52.92 54.02 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.064 0.459 . . . . 0.0 110.325 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.406 ' C ' ' O ' ' A' ' 102' ' ' LEU . 3.9 mm-40 -44.67 -18.33 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.583 ' N ' ' C ' ' A' ' 102' ' ' LEU . 13.5 tpp180 -84.54 -35.5 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.873 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.642 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.91 -40.71 94.19 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.406 HG21 HD11 ' A' ' 106' ' ' ILE . 1.3 mm -67.75 -40.32 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.611 0.72 . . . . 0.0 109.772 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.91 75.28 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.214 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -41.05 86.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.133 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.458 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.3 m -72.91 -47.89 41.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.225 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.43 -18.58 0.24 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.458 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -84.99 -52.86 5.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.274 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -47.12 -20.96 0.19 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.519 . . . . 0.0 109.74 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.442 ' N ' ' C ' ' A' ' 111' ' ' ALA . 20.1 m . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.039 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE2' ' OE1' ' A' ' 126' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.656 0.265 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.568 ' OE1' ' OE2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -60.89 -31.59 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.988 0.423 . . . . 0.0 110.177 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.43 -37.41 65.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.458 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.06 -65.8 0.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.2 pt -46.68 -32.84 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.411 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -63.02 -37.98 89.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.638 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -65.76 -39.38 91.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.8 t -57.73 -57.69 9.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.635 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.0 mp -48.77 -59.45 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.691 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -52.53 -58.48 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -51.23 -32.49 24.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.85 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.86 -179.731 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.884 0.373 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -58.61 7.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.794 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.46 HG23 ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -73.75 -41.26 62.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.334 0.588 . . . . 0.0 110.381 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.479 ' CE1' HD22 ' A' ' 40' ' ' LEU . 19.4 t80 -50.53 -61.02 2.44 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.142 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.25 -49.93 75.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.145 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -44.74 -41.21 6.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.665 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -65.17 -52.48 54.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.866 179.025 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.47 ' HA ' ' CD1' ' A' ' 27' ' ' ILE . 11.2 mt -43.66 -28.07 0.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.824 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.36 -23.12 24.68 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.131 0.491 . . . . 0.0 109.742 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.665 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -88.02 -56.69 3.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.016 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.47 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.14 -59.53 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 121.016 0.436 . . . . 0.0 111.741 -176.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.599 ' OG1' ' CD1' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -81.35 -13.53 58.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.24 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.36 31.97 82.12 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.599 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 0.4 OUTLIER -90.07 152.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.913 0.387 . . . . 0.0 110.532 -179.065 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -105.15 -39.38 6.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.746 -179.663 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -48.75 85.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.21 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.587 ' N ' ' O ' ' A' ' 31' ' ' ASN . 18.0 p -60.8 -20.21 61.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.012 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -66.99 -49.61 64.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 110.971 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.82 -31.23 52.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.137 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.59 -61.78 2.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.758 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.452 ' CG ' ' O ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -48.7 -27.24 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.245 0.545 . . . . 0.0 109.59 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.491 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 5.1 mt-30 -80.4 -37.95 31.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.372 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.76 97.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.114 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.615 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -62.54 -42.29 99.43 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.472 ' N ' HD13 ' A' ' 40' ' ' LEU . 1.9 mmtp -52.22 -33.39 41.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.908 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.506 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.5 OUTLIER -86.74 -43.87 12.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.599 179.559 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.746 ' HG ' ' H ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -65.63 -29.54 70.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.466 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 43' ' ' SER . 4.4 p30 48.65 53.16 12.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.056 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.38 -9.42 57.49 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.547 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.746 ' H ' ' HG ' ' A' ' 43' ' ' SER . 4.9 m120 -96.0 116.39 28.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.007 0.404 . . . . 0.0 110.198 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -77.41 -63.82 1.29 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.476 -178.492 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.427 ' C ' ' O ' ' A' ' 47' ' ' LEU . 24.9 tt0 -42.88 -20.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.6 mm? -87.69 -52.48 5.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.713 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.514 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -51.1 -47.15 62.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.733 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 6.5 p -63.21 -62.66 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 CA-C-O 121.517 0.675 . . . . 0.0 109.219 178.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.733 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -47.36 -27.42 1.62 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.236 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -65.74 -38.02 88.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.081 178.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.514 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.8 mp -69.8 -56.65 6.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.261 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.052 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.5 t70 . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.726 0.298 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 105' ' ' ALA . 3.0 pp -69.03 -42.09 76.82 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.423 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.496 ' H ' ' HG ' ' A' ' 102' ' ' LEU . 2.0 tp60 -50.4 -19.38 0.83 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.507 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.1 ttm180 -86.27 -32.65 20.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.398 -1.273 . . . . 0.0 110.003 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -56.47 -56.84 16.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.427 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' ' 107' ' ' ALA . 0.6 OUTLIER -77.53 -33.61 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.318 -179.217 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.462 ' N ' HD12 ' A' ' 106' ' ' ILE . . . -62.59 -59.87 4.32 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.283 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 4.8 tp -53.83 -35.68 61.72 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.15 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.514 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.6 t -64.27 -52.62 57.71 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -48.12 -18.58 0.21 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 108' ' ' LEU . . . -72.67 -53.92 10.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.817 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -46.51 -23.08 0.33 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.471 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.88 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.758 0.313 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -59.02 -37.98 78.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.601 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -73.36 -38.16 65.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.511 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.35 -54.62 43.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.688 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.414 HG13 ' N ' ' A' ' 130' ' ' SER . 31.7 pt -59.39 -36.32 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.6 m -63.38 -74.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.502 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 130' ' ' SER . 2.3 tpp180 -33.8 -65.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.387 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 133' ' ' LEU . 79.5 t -39.48 -61.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.526 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.456 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER -35.53 -51.74 0.64 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.514 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.606 ' C ' ' H ' ' A' ' 136' ' ' SER . 48.6 mt-10 -63.55 -64.68 0.83 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.579 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.59 9.49 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.721 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.606 ' H ' ' C ' ' A' ' 134' ' ' GLU . 13.5 t . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.635 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.606 0.241 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.422 ' NE2' ' H ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -45.56 -58.37 3.45 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.912 -179.354 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -58.92 -48.15 82.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.058 0.456 . . . . 0.0 111.312 -179.222 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.518 ' N ' ' CG2' ' A' ' 19' ' ' THR . 22.8 t80 -49.3 -59.0 4.09 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.953 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 mt -61.8 -39.43 91.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.029 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.666 ' OD1' ' NH2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -53.41 -40.81 65.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.647 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.6 mt-30 -59.58 -52.08 67.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.575 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.478 ' O ' ' CG2' ' A' ' 28' ' ' THR . 9.9 mt -44.35 -36.58 2.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.588 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.666 ' NH2' ' OD1' ' A' ' 22' ' ' ASN . 2.1 ttm105 -77.43 -19.26 56.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.715 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.4 tt0 -87.62 -58.59 2.52 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.476 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -60.77 -59.8 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.313 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.478 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -85.08 -3.08 58.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.42 -178.725 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 60.66 30.81 73.23 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.214 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.488 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 17.1 mm -82.84 147.41 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 117.213 0.507 . . . . 0.0 110.56 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -104.8 -50.67 3.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.99 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -43.36 103.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.548 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.411 ' H ' ' HG1' ' A' ' 33' ' ' THR . 16.6 p -68.59 -25.53 64.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.14 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -64.65 -44.86 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.97 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.98 -25.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.451 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.469 HD22 ' N ' ' A' ' 36' ' ' LEU . 4.6 mt -69.81 -50.18 45.52 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.877 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.46 -32.05 69.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.093 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -72.74 -38.18 67.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.332 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.505 ' O ' ' OG ' ' A' ' 43' ' ' SER . . . -63.98 -34.7 78.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.469 HD13 ' CD1' ' A' ' 20' ' ' PHE . 3.6 tt -65.85 -44.83 84.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.162 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.9 mmtp -59.17 -34.77 72.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.74 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.512 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -86.2 -13.46 46.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.662 ' HG ' ' CA ' ' A' ' 50' ' ' ALA . 14.4 m -97.13 -30.34 13.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.315 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.476 ' CB ' ' O ' ' A' ' 43' ' ' SER . 5.7 t30 77.73 24.38 0.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.134 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.12 8.68 47.0 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -97.17 130.95 44.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.507 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.3 OUTLIER -82.54 -63.55 1.35 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.426 -178.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -45.44 -21.5 0.1 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.651 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 3.2 mm? -87.97 -45.64 10.05 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.662 ' CA ' ' HG ' ' A' ' 43' ' ' SER . . . -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.702 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 4.2 p -59.87 -61.13 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.702 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -46.55 -42.33 15.7 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.159 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -52.7 -28.83 23.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.81 178.692 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 51' ' ' VAL . 6.2 mt -83.18 -49.19 9.72 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.48 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 121.047 0.451 . . . . 0.0 109.889 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.773 0.321 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.592 ' C ' ' N ' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -75.55 -53.41 8.67 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.484 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.432 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -43.91 -19.39 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.592 ' N ' ' C ' ' A' ' 102' ' ' LEU . 9.6 mtp180 -87.22 -39.21 15.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.391 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -52.88 -57.24 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.433 ' CD1' ' H ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -64.83 -55.35 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 CA-C-O 121.602 0.715 . . . . 0.0 110.339 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.01 -46.15 5.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.652 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -46.52 88.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.848 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.519 ' C ' ' N ' ' A' ' 111' ' ' ALA . 6.7 t -68.43 -53.21 25.14 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.616 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 tp -47.48 -17.77 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.519 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -79.99 -56.96 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.576 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -46.32 -24.25 0.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.624 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.416 ' N ' ' C ' ' A' ' 111' ' ' ALA . 58.2 m . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.178 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.583 ' OE1' ' N ' ' A' ' 126' ' ' GLU . 2.4 tm-20 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.851 0.358 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.583 ' N ' ' OE1' ' A' ' 125' ' ' GLU . 20.2 tt0 -48.78 -43.04 37.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.268 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.66 -45.93 92.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.255 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.44 -59.39 4.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.377 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.5 mm -42.78 -55.65 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.781 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.05 -52.09 12.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.736 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -46.6 -48.49 19.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.93 -54.66 28.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.786 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.413 ' N ' HD22 ' A' ' 133' ' ' LEU . 4.0 mm? -49.7 -44.29 48.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.68 -61.24 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -41.98 -30.13 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.492 -179.947 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' CD1' ' A' ' 21' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.595 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 4.7 mt-30 -71.64 -25.22 62.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.316 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -71.08 -51.38 25.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.228 0.537 . . . . 0.0 110.484 -179.527 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.595 ' N ' ' CG2' ' A' ' 19' ' ' THR . 42.6 t80 -60.02 -53.92 52.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.032 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.425 ' CD1' ' O ' ' A' ' 17' ' ' GLN . 13.3 mt -59.8 -45.75 91.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.148 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.595 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -50.05 -49.7 50.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.462 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.601 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.3 mm100 -54.9 -56.05 23.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.92 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.459 ' HA ' ' CD1' ' A' ' 27' ' ' ILE . 1.1 tp -44.92 -28.79 0.71 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.319 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -87.59 -24.26 24.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.152 0.501 . . . . 0.0 109.939 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' A' ' 23' ' ' GLN . 62.6 tt0 -88.25 -56.67 3.22 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.459 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -52.88 -59.6 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.427 -176.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.527 ' OG1' ' CD1' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -87.2 -6.49 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.742 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.99 9.9 67.33 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.35 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.527 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 2.0 mm -59.43 153.31 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 117.666 0.733 . . . . 0.0 110.287 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.41 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 4.4 p30 -113.47 -42.74 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.854 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.1 m-20 -44.89 101.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.557 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.9 m -67.13 -31.51 72.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.191 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.421 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.3 OUTLIER -65.02 -37.03 86.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.857 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.421 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 42.8 mm -67.24 -39.75 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.907 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 39' ' ' ALA . 7.2 mt -61.19 -60.71 3.34 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.378 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -45.61 -32.87 2.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.041 0.448 . . . . 0.0 110.276 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -81.43 -30.48 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.544 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -74.87 -24.11 58.51 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.605 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 2.0 tm? -77.68 -42.6 34.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.009 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -62.2 -43.22 99.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.532 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.598 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 80.4 m-20 -86.19 -22.45 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 39' ' ' ALA . 1.7 t -63.93 -30.96 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.629 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.598 ' ND2' ' O ' ' A' ' 42' ' ' ASP . 0.9 OUTLIER 79.88 9.26 1.47 Allowed 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.901 -0.319 . . . . 0.0 110.496 -179.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.15 15.45 25.84 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.488 ' O ' ' OG ' ' A' ' 43' ' ' SER . 0.6 OUTLIER -104.85 131.07 52.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.637 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.461 HD22 ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -78.96 -61.07 2.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.006 -178.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -54.01 -25.84 23.25 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.635 ' CD2' ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -88.53 -25.98 22.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.115 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.635 ' N ' ' CD2' ' A' ' 49' ' ' LEU . . . -79.85 -54.21 6.04 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 11.6 p -44.11 -40.18 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.55 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -64.9 -33.64 76.5 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.425 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.634 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.7 OUTLIER -54.35 -33.1 58.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.523 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.75 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -87.59 -52.48 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.836 -179.082 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.8 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.313 -179.634 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.708 0.289 . . . . 0.0 110.851 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 103' ' ' GLN . 1.1 pp -65.54 -33.2 75.36 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.436 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -57.69 -19.32 26.23 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.043 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -87.11 -29.22 22.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.166 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.96 -57.8 10.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.239 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.448 HD11 ' N ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -71.79 -35.31 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.712 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.448 ' N ' HD11 ' A' ' 106' ' ' ILE . . . -57.38 -52.54 64.94 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.2 -38.87 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.557 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.473 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -70.33 -42.89 71.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.232 179.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.4 mp -48.55 -19.14 0.3 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.473 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.1 2.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.406 179.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -47.43 -20.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.942 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.419 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.007 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.851 0.358 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.34 -40.6 65.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.392 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -25.9 65.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.72 -57.48 3.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.702 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.2 mt -53.8 -45.56 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.677 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 131' ' ' ARG . 1.4 t -60.54 -64.97 0.77 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.671 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 130' ' ' SER . 5.7 mtp85 -38.54 -49.95 1.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.48 ' O ' ' OG ' ' A' ' 136' ' ' SER . 46.6 t -58.75 -51.32 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.721 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.4 ' O ' ' OG ' ' A' ' 136' ' ' SER . 5.0 mt -43.46 -57.46 3.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.758 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . 0.434 ' C ' ' OE1' ' A' ' 134' ' ' GLU . 11.8 tm-20 -53.11 -57.33 10.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.586 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -50.91 -26.18 5.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 132' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.54 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.887 0.375 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.6 OUTLIER -46.59 -41.88 15.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.364 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.459 HG21 ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -68.04 -40.18 82.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.533 0.682 . . . . 0.0 109.651 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.47 ' CE1' ' HB2' ' A' ' 40' ' ' LEU . 10.0 t80 -57.82 -56.25 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.934 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.1 mt -64.22 -45.76 86.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.974 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.512 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 14.0 t-20 -46.45 -38.72 9.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -42.99 84.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.741 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.47 ' O ' ' CG2' ' A' ' 28' ' ' THR . 20.3 mt -54.45 -58.66 6.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -59.03 -18.09 31.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.278 0.561 . . . . 0.0 109.702 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -76.94 -44.73 30.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.288 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.544 HD13 ' H ' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -91.38 -41.31 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.423 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.51 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.8 t -95.18 -4.73 45.44 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.941 -177.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.52 31.52 66.99 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.41 -0.424 . . . . 0.0 112.449 178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.504 HG23 HD11 ' A' ' 30' ' ' ILE . 47.1 mm -90.07 112.39 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.586 -0.445 . . . . 0.0 110.056 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.494 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.5 p30 -76.66 -41.7 44.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.16 90.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.411 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -58.03 -37.09 73.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.772 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.37 -44.12 84.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.031 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.445 HG22 HD13 ' A' ' 35' ' ' ILE . 38.3 mm -67.88 -28.85 42.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.253 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.33 -51.78 33.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.166 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -53.22 -27.29 21.16 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.39 -25.18 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.326 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.98 -40.01 32.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.246 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.648 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.77 -29.7 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.019 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.474 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -69.7 -43.92 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.766 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.47 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.7 m-20 -74.55 -19.31 60.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.776 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.589 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -82.97 -30.79 27.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.928 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.589 ' OD1' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 80.66 23.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.095 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.52 8.63 42.98 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.548 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.1 m120 -96.58 130.75 43.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.514 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.1 OUTLIER -83.46 -63.05 1.43 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.402 ' C ' ' O ' ' A' ' 47' ' ' LEU . 21.2 tt0 -45.56 -21.82 0.12 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.665 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.8 mm? -85.87 -42.89 13.72 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.31 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -61.11 -56.74 17.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.637 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 1.1 p -50.16 -65.17 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.637 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -45.83 -42.26 12.14 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.037 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -54.78 -31.11 58.41 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 51' ' ' VAL . 3.3 mt -87.15 -50.23 6.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.293 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.412 ' H ' HG21 ' A' ' 55' ' ' THR . 10.6 p . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . 0.426 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.281 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.434 ' N ' HD21 ' A' ' 102' ' ' LEU . 4.2 mm? -55.38 -33.77 63.73 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 120.417 -0.513 . . . . 0.0 109.658 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.463 ' O ' ' CB ' ' A' ' 107' ' ' ALA . 21.3 tp60 -55.18 -19.74 8.67 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.426 ' CB ' ' O ' ' A' ' 101' ' ' ASP . 23.7 ttt180 -85.92 -32.57 21.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.354 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.68 -57.8 11.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.547 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.459 HD11 ' N ' ' A' ' 107' ' ' ALA . 0.7 OUTLIER -74.24 -31.86 30.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 CA-C-O 121.087 0.47 . . . . 0.0 111.188 -179.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 103' ' ' GLN . . . -62.15 -52.18 64.86 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.25 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.3 mp -57.83 -38.7 76.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.987 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.503 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -72.36 -54.66 8.8 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.191 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.49 -17.93 0.11 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -85.88 -47.72 9.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.301 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.05 -22.53 0.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.461 ' N ' ' C ' ' A' ' 111' ' ' ALA . 62.0 m . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.505 ' H ' ' CD ' ' A' ' 125' ' ' GLU . 1.1 pm0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -54.89 -44.77 74.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.516 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.02 -31.11 72.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.546 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.4 -75.67 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.397 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ILE . . . . . 0.52 ' CG2' ' N ' ' A' ' 130' ' ' SER . 18.9 tt -44.58 -45.67 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.319 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.52 ' N ' ' CG2' ' A' ' 129' ' ' ILE . 4.0 p -57.55 -40.95 79.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.28 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -47.54 63.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.195 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -56.16 -43.51 76.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.123 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.39 -56.52 16.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.209 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.47 -37.34 56.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.315 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.466 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 91.5 m -98.31 56.49 1.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.553 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.416 ' C ' ' H ' ' A' ' 5' ' ' GLN . 8.9 p -49.98 126.51 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.618 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.16 40.64 0.35 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.619 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.425 ' O ' ' CB ' ' A' ' 6' ' ' ASN . 1.0 OUTLIER -158.43 -171.59 3.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.549 179.923 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 2.3 m-20 166.32 -65.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.401 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -173.76 103.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.491 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.673 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -81.22 144.83 31.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.108 0.48 . . . . 0.0 110.761 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -134.62 98.36 4.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.906 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 47.65 -143.53 0.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.719 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 m 65.55 52.75 1.31 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.379 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.94 -49.58 13.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.519 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.55 -37.83 68.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.179 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -73.62 -26.86 60.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.224 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -57.87 -18.83 25.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.457 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -59.16 2.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.957 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.699 ' H ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -58.02 -32.96 68.45 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.856 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -60.43 -54.19 48.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.539 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.623 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -62.73 -51.5 66.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.725 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.623 ' N ' ' CG2' ' A' ' 19' ' ' THR . 55.9 t80 -55.75 -53.02 61.72 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.143 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.56 -48.45 79.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.287 178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -50.22 -43.55 52.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.246 178.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.4 mt-30 -56.73 -53.54 56.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.087 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.528 ' O ' ' CG2' ' A' ' 28' ' ' THR . 11.7 mt -43.29 -35.39 1.47 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 123.336 0.397 . . . . 0.0 110.779 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -76.42 -21.41 56.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.174 0.511 . . . . 0.0 109.79 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.664 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.8 tt0 -87.36 -58.49 2.56 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.506 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -59.18 -59.6 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.431 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.6 OUTLIER -82.65 -2.84 55.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 -178.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.42 25.02 59.99 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.531 HG21 ' H ' ' A' ' 32' ' ' ASP . 3.3 mm -69.28 159.78 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.131 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.467 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 17.2 m-20 -132.36 22.25 4.39 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.283 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.531 ' H ' HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -103.85 121.19 42.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.461 ' O ' ' OE1' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -82.07 -26.48 33.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.249 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -83.96 -46.75 11.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 0.0 111.151 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.426 HD13 ' N ' ' A' ' 35' ' ' ILE . 6.3 mm -66.8 -20.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.081 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.408 ' O ' ' N ' ' A' ' 39' ' ' ALA . 0.5 OUTLIER -74.12 -63.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.064 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.461 ' OE1' ' O ' ' A' ' 33' ' ' THR . 7.1 pt20 -50.86 -25.0 3.98 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -75.47 -38.99 59.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.388 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.408 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -65.34 -19.15 65.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.895 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.475 HD12 ' CE2' ' A' ' 20' ' ' PHE . 12.2 tp -79.14 -52.99 7.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.603 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -51.81 -33.77 37.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -27.77 27.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.59 ' OG ' ' N ' ' A' ' 50' ' ' ALA . 3.6 m -80.51 -30.65 37.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.815 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 61.92 35.05 16.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.289 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.33 4.63 50.04 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.681 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.425 ' ND2' ' O ' ' A' ' 43' ' ' SER . 6.6 m-80 -93.8 130.96 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -84.76 -62.62 1.5 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.71 -178.013 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -52.75 -21.87 4.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.025 0.441 . . . . 0.0 110.289 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.685 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -81.49 -54.85 5.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.199 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.59 ' N ' ' OG ' ' A' ' 43' ' ' SER . . . -52.44 -36.75 55.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.421 ' CG2' HD12 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -63.26 -49.53 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.34 177.697 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.736 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -57.0 -44.13 82.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.785 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -60.55 -24.56 65.48 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.863 -0.735 . . . . 0.0 110.816 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 50' ' ' ALA . 68.6 mt -87.37 -53.57 4.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.744 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 57' ' ' LYS . 12.9 t -91.06 -38.45 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.736 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 35.12 20.54 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.249 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.689 ' N ' ' O ' ' A' ' 55' ' ' THR . 13.1 mtpp -137.19 -100.42 0.2 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.009 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.579 ' O ' ' CB ' ' A' ' 59' ' ' ALA . 10.4 m120 -108.73 -164.16 0.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.87 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.579 ' CB ' ' O ' ' A' ' 58' ' ' ASN . . . 156.61 138.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.475 ' HG3' ' N ' ' A' ' 61' ' ' THR . 2.4 ptpt -121.31 -123.64 0.28 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.402 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.746 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 9.0 m -162.13 -37.33 0.0 OUTLIER Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.79 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.746 ' CD ' ' H ' ' A' ' 61' ' ' THR . 12.5 Cg_endo -88.29 16.01 1.97 Allowed 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.895 2.396 . . . . 0.0 111.871 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -57.91 -84.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.685 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.435 ' O ' ' CD ' ' A' ' 64' ' ' GLN . 1.2 tm0? -124.15 100.79 6.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.42 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 67' ' ' THR . 4.9 tp10 -68.15 120.29 14.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.624 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 65' ' ' GLU . 6.4 tt0 -37.14 93.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -98.24 -46.88 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.989 -179.705 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.474 ' H ' HG22 ' A' ' 67' ' ' THR . 4.2 t -160.71 -179.16 7.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.96 0.409 . . . . 0.0 111.008 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 1.6 p90 -157.25 70.18 0.6 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.227 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -148.12 -85.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.649 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -96.46 35.02 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.595 ' O ' ' N ' ' A' ' 74' ' ' LEU . 4.4 m 44.23 17.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.545 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.513 ' O ' ' C ' ' A' ' 74' ' ' LEU . . . 42.26 15.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.46 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' THR . 7.9 tp -28.35 93.75 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.511 ' N ' ' O ' ' A' ' 73' ' ' ALA . 74.4 Cg_endo -80.71 16.43 1.59 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.611 2.207 . . . . 0.0 112.008 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 165.51 150.07 6.11 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.603 ' O ' ' CB ' ' A' ' 78' ' ' ASP . 0.0 OUTLIER -100.21 -88.09 0.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.78 0.324 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.603 ' CB ' ' O ' ' A' ' 77' ' ' ASN . 0.1 OUTLIER 152.99 157.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.403 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -66.1 125.8 26.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.24 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.564 ' O ' ' C ' ' A' ' 81' ' ' ILE . 0.8 OUTLIER -82.48 -169.9 2.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.303 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.564 ' C ' ' O ' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -22.51 -84.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.867 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.411 ' H ' ' CG1' ' A' ' 81' ' ' ILE . 0.9 OUTLIER -170.78 -170.14 0.86 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.727 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -72.7 179.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.605 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -77.34 -51.78 5.93 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 67.48 70.2 0.36 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -73.89 174.02 9.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.654 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.13 141.91 49.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.352 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.6 30.5 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.66 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 p -65.59 121.98 16.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -171.25 26.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.013 0.435 . . . . 0.0 110.047 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.612 ' O ' ' O ' ' A' ' 92' ' ' ILE . 14.0 m -99.89 -116.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.039 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.612 ' O ' ' O ' ' A' ' 91' ' ' VAL . 1.6 tt 31.33 -161.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.584 ' H ' ' CG1' ' A' ' 92' ' ' ILE . 15.1 m-20 -152.42 134.91 15.23 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.076 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.5 mp -75.84 -36.52 59.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.459 HG22 ' H ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -96.5 -47.08 6.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.699 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.459 ' H ' HG22 ' A' ' 95' ' ' THR . . . 79.34 13.02 83.25 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.453 ' H ' ' HG1' ' A' ' 95' ' ' THR . 0.1 OUTLIER 37.85 79.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 0.0 110.584 -179.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.77 81.5 1.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.431 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -92.94 -1.48 56.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.783 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.65 -15.62 63.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.761 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.448 ' N ' ' OD1' ' A' ' 101' ' ' ASP . 1.0 OUTLIER -51.17 -55.61 17.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.075 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.611 ' CD1' ' C ' ' A' ' 102' ' ' LEU . 0.2 OUTLIER -56.12 -35.65 67.32 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.581 -179.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.453 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 2.1 tt0 -53.91 -19.51 4.66 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.441 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.1 ttt180 -86.54 -33.05 20.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.857 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.55 -53.97 49.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.159 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -47.33 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.352 0.596 . . . . 0.0 110.573 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.82 -57.34 7.56 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.158 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.59 -44.75 18.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.102 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.467 ' C ' ' N ' ' A' ' 111' ' ' ALA . 8.7 t -63.87 -44.43 93.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.218 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.483 ' CD2' ' O ' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -48.61 -19.02 0.3 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.467 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -86.45 -57.99 2.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.65 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -47.77 -18.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.307 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.608 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -90.27 -54.47 4.0 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.627 179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -62.19 3.46 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.102 0.477 . . . . 0.0 109.755 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.608 ' H ' ' C ' ' A' ' 113' ' ' SER . 3.0 mpt_? -118.59 -27.87 5.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.678 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -86.54 -18.52 31.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.905 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.27 174.26 7.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.256 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.664 ' C ' ' H ' ' A' ' 120' ' ' THR . 7.2 mtp85 -127.23 23.77 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.873 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 64.23 -32.99 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.664 ' H ' ' C ' ' A' ' 118' ' ' ARG . 28.1 p -70.57 -109.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.17 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . 0.577 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 119.72 -35.45 3.83 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.602 ' CD1' ' H ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -73.67 -16.15 17.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.782 0.325 . . . . 0.0 110.65 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.433 ' H ' HD13 ' A' ' 122' ' ' ILE . 17.0 p 56.02 60.54 3.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.699 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -79.03 3.22 17.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.567 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.414 ' CD ' ' N ' ' A' ' 126' ' ' GLU . 1.9 pp20? -59.98 -39.93 87.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.694 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' A' ' 125' ' ' GLU . 1.8 tt0 -55.42 -53.26 58.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.862 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.51 -27.67 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.632 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 130' ' ' SER . . . -72.91 -84.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.619 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.544 ' C ' ' O ' ' A' ' 128' ' ' ALA . 2.6 mt -26.9 -39.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.77 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.59 ' N ' ' O ' ' A' ' 128' ' ' ALA . 9.1 m -62.43 -68.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.645 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -43.49 -25.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.677 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.527 ' O ' ' N ' ' A' ' 135' ' ' ALA . 41.7 t -75.42 -62.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.643 ' O ' ' N ' ' A' ' 138' ' ' ALA . 14.5 mt -37.55 -56.18 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.76 ' O ' ' N ' ' A' ' 137' ' ' ILE . 39.9 tt0 -56.09 -41.21 74.83 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.875 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.527 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -36.4 -61.0 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.666 ' O ' ' CG2' ' A' ' 137' ' ' ILE . 0.0 OUTLIER -74.59 -7.75 54.13 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.76 ' N ' ' O ' ' A' ' 134' ' ' GLU . 7.5 tt 102.53 40.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.952 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . 15.77 -91.84 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.233 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.407 ' O ' ' O ' ' A' ' 137' ' ' ILE . 15.4 tt0 -67.88 -144.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -157.61 135.7 10.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.605 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -87.7 -83.0 0.21 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.408 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.06 90.91 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.528 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 27.8 p -46.38 154.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.758 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.568 ' CD2' ' N ' ' A' ' 144' ' ' LEU . 3.3 mm? -92.59 -159.74 0.69 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.435 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -75.44 -10.47 59.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.544 -179.911 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 3' ' ' VAL . 2.7 mtt . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.595 ' O ' ' O ' ' A' ' 3' ' ' VAL . 17.4 m -56.99 80.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.412 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 2' ' ' THR . 48.4 t -42.31 -107.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.701 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.682 ' O ' ' N ' ' A' ' 6' ' ' ASN . 32.1 mm-40 -93.49 -77.97 0.44 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.372 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.593 ' O ' ' CB ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.79 -79.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.64 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.682 ' N ' ' O ' ' A' ' 4' ' ' GLU . 3.7 t30 88.88 -174.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.336 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.436 ' H ' ' ND2' ' A' ' 6' ' ' ASN . 1.1 m -139.02 143.94 30.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.546 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.66 102.34 4.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.059 0.457 . . . . 0.0 110.448 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.499 ' HG3' ' H ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -50.81 -179.78 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.474 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.588 ' CG ' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -123.55 -129.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.604 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.588 ' H ' ' CG ' ' A' ' 10' ' ' GLN . 77.6 p -125.82 -97.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.413 ' N ' ' OG ' ' A' ' 11' ' ' SER . . . -47.8 -16.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.731 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.439 ' N ' ' C ' ' A' ' 11' ' ' SER . . . -79.24 -25.89 42.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.529 ' CG ' ' N ' ' A' ' 15' ' ' LYS . 8.2 pt20 -84.34 -43.48 14.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.754 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.529 ' N ' ' CG ' ' A' ' 14' ' ' GLN . 10.0 ptmm? -59.77 -27.26 66.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.954 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -79.7 -50.12 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.769 0.319 . . . . 0.0 110.941 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -52.89 -40.98 63.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.936 0.398 . . . . 0.0 110.749 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -60.21 -43.34 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.12 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.462 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -81.03 -42.06 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.215 0.531 . . . . 0.0 110.853 -179.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.469 ' CE1' HD23 ' A' ' 40' ' ' LEU . 29.4 t80 -56.84 -56.86 16.17 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.564 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.0 mt -64.46 -39.91 94.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.105 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.62 -40.73 75.87 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.07 -47.5 80.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.056 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 28' ' ' THR . 14.7 mt -51.16 -53.57 33.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.179 0.514 . . . . 0.0 110.644 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.643 ' C ' ' HE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -60.07 -16.57 32.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.26 0.553 . . . . 0.0 109.593 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -82.08 -57.47 3.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.527 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -78.27 -46.81 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.365 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.527 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.0 t -92.35 -3.17 55.75 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.665 -177.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.57 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . 62.72 -7.6 0.25 Allowed Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.708 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.446 HG12 ' OG1' ' A' ' 28' ' ' THR . 41.1 mm -59.17 97.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 117.911 0.856 . . . . 0.0 110.301 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 29' ' ' GLY . 3.8 m-20 -83.06 36.56 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.134 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -106.91 85.56 2.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.9 0.381 . . . . 0.0 110.114 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -43.7 -37.05 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.019 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -47.22 83.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.656 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.464 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.7 mp -75.62 -33.08 25.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.657 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.41 ' CD2' HD23 ' A' ' 54' ' ' LEU . 5.8 mt -65.35 -63.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -51.3 -28.13 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.097 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -78.21 -39.43 40.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.84 82.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.048 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.599 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 tm? -67.93 -43.05 80.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.79 -40.26 20.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.577 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.478 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.5 t0 -87.3 -40.19 14.7 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.602 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -63.87 -24.29 67.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.682 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 1.4 p-10 50.35 42.15 25.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.558 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.64 -1.39 49.13 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.063 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.602 ' O ' ' OG ' ' A' ' 43' ' ' SER . 0.8 OUTLIER -96.85 122.8 40.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 50' ' ' ALA . 21.6 tp -84.99 -61.79 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.248 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' A' ' 47' ' ' LEU . 5.3 mt-10 -42.73 -21.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.708 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -89.61 -39.3 13.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.618 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -67.38 -54.83 17.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.596 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 10.1 p -53.46 -53.16 26.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.689 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -52.54 -45.02 66.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.455 -1.248 . . . . 0.0 109.586 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.478 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -49.18 -27.81 3.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.636 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.2 mp -85.86 -52.42 5.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.737 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.515 ' O ' ' C ' ' A' ' 56' ' ' ALA . 2.6 t -82.27 -45.58 14.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.479 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.689 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -31.25 144.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.363 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.557 ' C ' ' ND2' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.913 0.387 . . . . 0.0 110.635 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.557 ' ND2' ' C ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -168.9 41.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.154 179.752 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 70.51 -146.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.407 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -88.0 -137.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.434 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.43 ' N ' ' HD3' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -148.47 64.32 7.81 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.41 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.43 ' HD3' ' N ' ' A' ' 61' ' ' THR . 73.0 Cg_endo -84.27 -101.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.302 -1.88 0 C-N-CA 123.267 2.645 . . . . 0.0 112.163 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.534 ' CD ' ' O ' ' A' ' 63' ' ' GLN . 16.1 tm0? 50.15 64.28 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.621 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 51.03 89.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.525 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -97.34 5.61 49.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.68 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -80.2 -96.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.742 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.419 ' O ' ' OG1' ' A' ' 68' ' ' THR . 21.7 m -40.93 101.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.69 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.686 ' CG2' ' H ' ' A' ' 69' ' ' TYR . 27.8 m -166.93 -176.68 3.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.306 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.686 ' H ' ' CG2' ' A' ' 68' ' ' THR . 9.0 p90 -150.64 133.38 15.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.543 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -108.91 -172.4 2.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.328 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -120.73 -6.44 9.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.299 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.6 m -87.2 102.39 14.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.364 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -171.4 122.85 0.55 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.77 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 56.7 tp -90.11 -27.28 0.32 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.495 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.77 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 39.3 Cg_exo -57.24 55.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.529 2.153 . . . . 0.0 112.12 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.671 ' N ' ' O ' ' A' ' 74' ' ' LEU . . . -117.49 83.31 0.34 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -157.06 139.13 14.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.838 0.351 . . . . 0.0 110.541 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 80' ' ' TYR . 0.3 OUTLIER -122.84 -169.2 1.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.545 179.831 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.3 -88.16 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.577 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.469 ' CZ ' ' HB3' ' A' ' 78' ' ' ASP . 8.2 m-85 71.32 160.01 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.974 0.416 . . . . 0.0 110.541 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.613 ' C ' ' HG ' ' A' ' 82' ' ' SER . 20.5 mt 70.65 119.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.478 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.613 ' HG ' ' C ' ' A' ' 81' ' ' ILE . 0.0 OUTLIER 172.18 -25.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.709 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.417 HG21 ' N ' ' A' ' 84' ' ' GLY . 2.5 p -118.0 144.5 25.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.648 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.436 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . -115.01 -92.63 1.86 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.541 ' O ' ' O ' ' A' ' 86' ' ' GLN . 0.3 OUTLIER 165.66 65.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.844 0.354 . . . . 0.0 110.69 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.541 ' O ' ' O ' ' A' ' 85' ' ' SER . 1.8 mt-30 33.96 -157.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.44 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -141.3 150.44 42.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.537 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.534 ' O ' ' OG1' ' A' ' 89' ' ' THR . 5.7 p-10 -57.33 -22.35 41.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.315 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.557 ' O ' ' OD1' ' A' ' 90' ' ' ASN . 77.7 p 53.55 175.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.528 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.557 ' OD1' ' O ' ' A' ' 89' ' ' THR . 1.5 m120 -171.06 37.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.174 0.512 . . . . 0.0 110.002 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 92' ' ' ILE . 2.0 m -115.01 -104.02 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.94 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.588 ' O ' ' O ' ' A' ' 91' ' ' VAL . 0.4 OUTLIER 30.61 -157.28 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.179 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.587 ' N ' ' CG2' ' A' ' 92' ' ' ILE . 0.9 OUTLIER 61.64 101.03 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.494 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.421 ' N ' HD13 ' A' ' 94' ' ' LEU . 6.6 mp -81.92 29.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.795 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.08 -27.11 2.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.418 ' O ' ' C ' ' A' ' 97' ' ' ASP . . . -69.48 -25.31 75.62 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -38.3 -59.13 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.819 0.342 . . . . 0.0 110.427 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.41 144.32 42.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.307 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.489 ' CG ' ' N ' ' A' ' 100' ' ' ASP . 0.4 OUTLIER -87.84 -49.76 6.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.528 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.489 ' N ' ' CG ' ' A' ' 99' ' ' LYS . 38.4 t0 -53.37 -21.35 5.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.396 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -47.13 81.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.538 ' C ' ' N ' ' A' ' 104' ' ' ARG . 2.4 mm? -73.02 -46.43 52.1 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.118 0.485 . . . . 0.0 109.84 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -44.99 -20.11 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.538 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.2 ttt-85 -85.69 -45.79 11.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.116 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -53.97 -47.42 71.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.87 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.413 ' H ' HG12 ' A' ' 106' ' ' ILE . 8.2 mm -62.28 -57.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 121.668 0.747 . . . . 0.0 109.924 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -45.31 -44.02 11.2 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.055 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.31 -39.23 66.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.148 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.464 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.7 OUTLIER -73.49 -46.73 46.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.238 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -48.39 -17.89 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.464 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -87.99 -58.41 2.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.572 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -47.58 -24.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.557 ' O ' ' N ' ' A' ' 115' ' ' ARG . 46.6 t -87.5 -47.01 9.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.929 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -45.56 -14.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.557 ' N ' ' O ' ' A' ' 113' ' ' SER . 1.7 mpt_? -102.83 -37.17 7.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.589 179.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -96.61 29.08 3.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.545 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.491 ' O ' ' N ' ' A' ' 119' ' ' GLU . 52.1 t80 -102.38 -40.8 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.718 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -33.18 -36.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.623 -179.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.547 ' C ' ' O ' ' A' ' 118' ' ' ARG . 3.0 tt0 27.88 56.67 0.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.554 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 t -54.71 139.45 39.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.676 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -148.76 82.66 0.19 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 2.1 tt -119.11 148.65 21.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.775 0.321 . . . . 0.0 110.521 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 81.4 p -60.02 152.98 22.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.492 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -134.89 5.13 3.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.508 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -76.03 -29.59 58.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.492 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.4 -49.65 76.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.631 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.78 -30.33 69.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.521 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.48 73.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.541 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.8 mt -59.76 -58.21 8.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.587 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.91 -37.94 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.497 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.66 -56.65 18.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.533 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 4.1 t -44.38 -36.01 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.52 ' O ' ' C ' ' A' ' 134' ' ' GLU . 2.4 mp -67.69 -89.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.966 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.693 ' O ' ' N ' ' A' ' 137' ' ' ILE . 31.4 mt-10 -33.58 -49.72 0.31 Allowed 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.596 ' C ' ' H ' ' A' ' 137' ' ' ILE . . . -37.44 -69.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.479 ' O ' ' OG ' ' A' ' 136' ' ' SER . 0.1 OUTLIER -68.61 11.21 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.693 ' N ' ' O ' ' A' ' 134' ' ' GLU . 0.0 OUTLIER 74.57 43.98 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.41 -179.502 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.61 ' C ' ' O ' ' A' ' 137' ' ' ILE . . . 1.12 -68.15 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.588 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.641 ' N ' ' O ' ' A' ' 137' ' ' ILE . 10.3 mm-40 -87.63 139.34 30.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.939 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.601 ' N ' ' OD1' ' A' ' 140' ' ' ASN . 3.0 p-10 -131.89 51.64 2.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.525 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -70.72 -117.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.515 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 144' ' ' LEU . . . 40.74 -155.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.551 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 42.8 t 58.82 -85.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.643 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.414 ' N ' ' O ' ' A' ' 142' ' ' ALA . 0.7 OUTLIER -58.5 116.21 3.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.426 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -161.71 0.59 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.635 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.674 179.935 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.8 mmt . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.59 ' O ' ' O ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -75.49 167.18 22.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.404 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.59 ' O ' ' O ' ' A' ' 2' ' ' THR . 39.7 t -37.22 -105.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.46 ' N ' HG13 ' A' ' 3' ' ' VAL . 10.4 tt0 -132.72 60.87 1.69 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.592 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -117.51 149.9 39.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.698 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.604 ' O ' ' O ' ' A' ' 7' ' ' VAL . 63.5 m-20 54.11 40.34 31.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.941 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.604 ' O ' ' O ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 21.04 104.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.142 179.839 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.654 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -104.56 2.1 30.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.985 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.631 ' C ' ' H ' ' A' ' 11' ' ' SER . 0.3 OUTLIER -84.27 131.8 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.729 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.602 ' O ' ' C ' ' A' ' 11' ' ' SER . 1.3 tp60 64.55 -12.86 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.799 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.631 ' H ' ' C ' ' A' ' 9' ' ' GLN . 5.3 p 9.41 80.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.474 0.484 . . . . 0.0 111.534 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.16 -17.6 63.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.547 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.32 2.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.559 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -18.57 1.02 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.391 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -54.43 -35.8 63.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.672 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -75.83 -58.29 3.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.655 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -52.5 -32.26 39.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.873 0.368 . . . . 0.0 110.425 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -59.89 -55.09 38.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.622 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.601 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -68.51 -48.36 64.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.297 0.57 . . . . 0.0 110.313 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.601 ' N ' ' CG2' ' A' ' 19' ' ' THR . 40.0 t80 -47.35 -60.28 2.61 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.972 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.86 -52.07 65.64 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.956 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -45.14 -32.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.692 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -71.87 -48.8 43.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.882 179.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.502 ' CD1' ' CE1' ' A' ' 20' ' ' PHE . 1.9 mp -45.24 -25.67 0.4 Allowed 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.426 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -88.38 -24.39 23.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.766 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.692 ' N ' ' O ' ' A' ' 23' ' ' GLN . 5.6 tm-20 -86.84 -57.77 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.445 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.35 -59.68 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.113 -177.492 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.448 HG22 ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.5 -5.14 58.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.787 -179.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.35 32.65 76.01 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.209 -0.519 . . . . 0.0 111.893 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.1 mm -88.25 153.58 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.66 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.589 ' N ' ' OD1' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -108.08 -54.57 2.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.907 -179.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.402 ' CB ' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -41.24 101.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.353 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.3 m -66.7 -24.81 66.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.164 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -69.04 -51.71 36.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.756 0.312 . . . . 0.0 110.857 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.402 HD12 ' CB ' ' A' ' 32' ' ' ASP . 69.8 mt -53.21 -20.59 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 39' ' ' ALA . 4.6 mt -80.18 -60.66 2.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.725 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -43.38 -25.2 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.574 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.22 -39.87 32.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.004 179.349 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -63.18 -36.4 83.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.817 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.464 ' C ' ' CD2' ' A' ' 40' ' ' LEU . 7.0 tt -66.57 -40.45 88.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.005 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -52.83 -39.19 62.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.024 0.44 . . . . 0.0 109.891 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.4 m-20 -86.76 -30.0 21.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.699 ' HG ' ' N ' ' A' ' 46' ' ' ASN . 0.1 OUTLIER -79.38 -21.47 45.68 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.083 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 40' ' ' LEU . 36.3 m120 62.21 29.85 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.939 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.45 1.42 53.53 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.699 ' N ' ' HG ' ' A' ' 43' ' ' SER . 5.2 m-20 -88.07 130.65 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.257 . . . . 0.0 110.378 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.478 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -83.98 -63.39 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.242 -178.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -45.66 -22.4 0.17 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.42 0.629 . . . . 0.0 109.533 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.725 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -89.71 -41.17 12.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.316 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.47 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -63.23 -46.89 84.8 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.682 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 7.9 p -58.75 -59.12 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.684 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -50.07 -40.19 44.63 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.458 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -53.93 -32.84 54.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.161 179.096 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.47 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 5.4 mp -85.76 -51.95 6.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.354 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.614 ' O ' ' C ' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -71.74 -50.53 29.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.112 179.834 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.684 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 7.17 -102.83 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.697 0.623 . . . . 0.0 110.922 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.55 ' O ' ' CG ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -75.35 140.79 43.27 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.55 ' CG ' ' O ' ' A' ' 57' ' ' LYS . 13.4 p30 47.0 -160.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 176.85 47.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.019 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.567 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.0 OUTLIER -157.97 143.15 16.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.388 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.624 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -174.44 -39.97 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.443 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.624 ' CD ' ' H ' ' A' ' 61' ' ' THR . 14.5 Cg_exo -66.32 -22.62 52.71 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.619 2.213 . . . . 0.0 112.23 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 64' ' ' GLN . 0.0 OUTLIER -65.62 127.77 33.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.66 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 63' ' ' GLN . 5.6 tt0 38.6 58.05 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.569 ' OE1' ' O ' ' A' ' 65' ' ' GLU . 0.4 OUTLIER -86.74 -9.42 55.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.427 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.471 ' C ' ' O ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -34.7 120.64 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.357 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.41 ' O ' ' C ' ' A' ' 68' ' ' THR . 0.1 OUTLIER -143.53 -30.95 0.49 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.683 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.41 ' C ' ' O ' ' A' ' 67' ' ' THR . 4.6 m 40.17 77.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.374 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -179.26 74.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.521 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -146.4 -176.03 5.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.52 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -92.16 -108.98 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.401 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.572 ' O ' ' O ' ' A' ' 73' ' ' ALA . 40.8 p -131.7 -4.14 3.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.762 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.579 ' O ' ' O ' ' A' ' 74' ' ' LEU . . . 55.46 143.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.228 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.639 ' C ' ' H ' ' A' ' 76' ' ' GLY . 4.2 tp 31.37 98.9 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.417 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -47.65 -2.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.464 2.11 . . . . 0.0 111.825 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.639 ' H ' ' C ' ' A' ' 74' ' ' LEU . . . 72.5 126.53 0.09 OUTLIER Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 78' ' ' ASP . 13.1 t-20 -140.98 18.13 2.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.733 0.301 . . . . 0.0 110.525 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.448 ' C ' ' O ' ' A' ' 77' ' ' ASN . 0.7 OUTLIER -35.95 151.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.433 179.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.429 HH11 ' HD2' ' A' ' 79' ' ' ARG . 14.4 mtp180 -45.95 141.17 3.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.606 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.496 ' O ' ' N ' ' A' ' 82' ' ' SER . 0.2 OUTLIER -122.41 178.32 5.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.025 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.418 HD12 HG21 ' A' ' 81' ' ' ILE . 5.5 mt 65.49 -59.27 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 80' ' ' TYR . 1.2 p 43.88 -155.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.449 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.475 ' N ' ' OG ' ' A' ' 82' ' ' SER . 13.9 m -149.6 141.28 17.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.718 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -137.13 -97.55 0.47 Allowed Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 43.71 64.41 1.27 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 110.561 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.22 -36.08 8.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.435 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.9 137.19 1.84 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.599 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.75 89.36 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.497 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.16 114.43 16.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -161.42 28.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.355 0.598 . . . . 0.0 109.4 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.06 166.76 15.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.922 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.581 ' CG1' ' H ' ' A' ' 93' ' ' ASP . 1.1 tt 179.7 -159.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.581 ' H ' ' CG1' ' A' ' 92' ' ' ILE . 6.0 m-20 -151.44 -80.02 0.11 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.498 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 68.69 -45.74 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.459 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.64 ' O ' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -87.35 -34.52 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.502 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' C ' ' O ' ' A' ' 95' ' ' THR . . . 35.42 23.41 0.01 OUTLIER Glycine 0 CA--C 1.526 0.725 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.64 ' N ' ' O ' ' A' ' 95' ' ' THR . 21.7 m-20 60.76 170.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.766 0.317 . . . . 0.0 110.619 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.11 125.64 47.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.488 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 mmtp -89.27 -10.48 46.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -50.74 -32.35 19.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.438 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -51.26 -46.58 62.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.201 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.4 tt -71.86 -54.46 10.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.209 0.528 . . . . 0.0 110.292 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.4 tp60 -43.96 -17.96 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.599 ' N ' ' C ' ' A' ' 102' ' ' LEU . 3.6 tpt180 -86.69 -37.72 17.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.372 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -59.93 -38.75 83.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.206 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -75.06 -37.25 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.555 0.693 . . . . 0.0 110.023 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -56.87 14.09 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.123 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.535 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 12.2 tp -48.48 -53.94 16.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.116 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 105' ' ' ALA . 0.7 OUTLIER -57.69 -49.28 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.833 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.7 mt -48.32 -17.93 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 108' ' ' LEU . . . -79.33 -54.55 5.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.612 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.481 ' CD ' ' N ' ' A' ' 112' ' ' GLU . 0.3 OUTLIER -46.6 -23.13 0.35 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.617 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.5 OUTLIER -90.43 -54.52 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.903 179.31 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.6 -8.42 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.617 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.9 mpt_? -101.54 -52.22 3.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.872 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -54.13 -31.31 51.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.874 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -49.28 -75.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.477 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 118' ' ' ARG . 5.3 ptm180 -76.6 79.35 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.45 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.622 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -79.24 -8.99 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.432 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.7 OUTLIER -50.51 124.67 11.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.601 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -152.8 118.84 0.91 Allowed Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 87.4 mt -121.9 135.06 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 0.0 110.5 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.585 ' O ' ' N ' ' A' ' 125' ' ' GLU . 55.4 m -120.06 -101.1 0.43 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.55 ' C ' ' O ' ' A' ' 123' ' ' THR . 0.0 OUTLIER 25.89 41.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.585 ' N ' ' O ' ' A' ' 123' ' ' THR . 2.3 mm-40 -86.12 -49.18 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.681 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -58.31 -36.58 73.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.698 ' H ' HE21 ' A' ' 127' ' ' GLN . 0.0 OUTLIER -77.55 -51.02 11.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.748 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.83 -44.36 39.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.553 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.41 -62.1 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.508 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.27 -16.84 9.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.813 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.1 ttt-85 -76.03 -52.15 10.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.615 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 48.3 t -64.55 -52.93 48.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.406 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.69 -52.88 16.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.572 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -51.64 -52.1 50.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.402 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.37 -13.07 2.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.415 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.4 -3.28 15.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.462 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 2.0 tt -96.96 -10.98 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.62 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -91.56 172.99 8.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.501 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 140' ' ' ASN . 0.5 OUTLIER -79.59 126.9 31.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.715 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER -55.91 -159.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.63 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.17 -171.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.749 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -102.24 129.27 48.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.6 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 42.0 t -44.71 -75.74 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.437 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.561 ' O ' ' O ' ' A' ' 145' ' ' LYS . 0.3 OUTLIER -122.62 149.84 43.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.561 ' O ' ' O ' ' A' ' 144' ' ' LEU . 2.6 mtpt 37.85 -166.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.705 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.521 -179.976 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.0 ttt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.561 ' O ' ' C ' ' A' ' 3' ' ' VAL . 0.6 OUTLIER -79.7 -57.01 3.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.561 ' C ' ' O ' ' A' ' 2' ' ' THR . 13.5 p 21.48 82.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.436 ' OE1' ' OG1' ' A' ' 2' ' ' THR . 4.6 mp0 -84.83 27.01 0.78 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.386 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.444 ' O ' ' CD2' ' A' ' 8' ' ' LEU . 3.5 tt0 -112.8 88.38 2.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.421 ' O ' ' CB ' ' A' ' 7' ' ' VAL . 0.2 OUTLIER -65.28 -164.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.653 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.421 ' CB ' ' O ' ' A' ' 6' ' ' ASN . 2.5 t 76.76 -0.75 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.955 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.444 ' CD2' ' O ' ' A' ' 5' ' ' GLN . 0.4 OUTLIER -113.13 -7.77 13.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.957 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -111.32 57.77 0.62 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.875 0.369 . . . . 0.0 110.539 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -168.41 84.46 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.588 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -76.36 -1.12 25.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.15 -41.66 27.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.696 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -47.18 -25.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.697 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -76.54 -41.76 45.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.651 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -82.32 -19.01 40.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.796 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -63.43 -23.57 67.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.994 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -45.64 -22.05 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.422 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -55.36 -44.98 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.53 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.676 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -69.25 -43.5 73.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.644 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.474 ' N ' HG23 ' A' ' 19' ' ' THR . 38.3 t80 -50.96 -58.15 6.76 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.431 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.47 -42.27 96.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.004 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.59 -41.29 41.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.677 ' N ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -60.31 -46.54 89.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.095 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.497 ' O ' ' CG2' ' A' ' 28' ' ' THR . 40.9 mt -50.35 -57.95 6.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 109.927 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.429 ' CG ' ' O ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.07 -17.31 38.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.209 0.528 . . . . 0.0 109.752 179.333 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -78.86 -48.77 14.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.714 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.554 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -89.86 -46.92 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.162 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.554 ' N ' HG12 ' A' ' 27' ' ' ILE . 2.8 t -87.39 -2.84 58.9 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.373 -177.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.06 32.44 71.07 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.698 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.429 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 40.3 mm -89.77 128.65 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.281 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -94.03 -47.94 6.46 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.304 -179.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -41.07 98.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.576 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -77.11 -39.95 47.63 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.732 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 34.2 mm -72.46 -21.26 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.399 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.496 ' O ' ' N ' ' A' ' 39' ' ' ALA . 87.8 mt -76.0 -63.51 1.3 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.271 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.04 -26.0 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -73.53 -37.45 65.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.632 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.585 ' O ' ' OD1' ' A' ' 42' ' ' ASP . . . -60.37 -42.6 96.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.732 179.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.587 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.68 -36.06 79.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.379 179.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -53.44 -41.15 65.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.025 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.7 ' OD1' ' CD2' ' A' ' 53' ' ' PHE . 7.1 p30 -87.25 -23.96 24.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.478 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.583 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.4 OUTLIER -77.52 -7.52 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.686 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.692 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 56.77 25.22 9.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.214 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.45 -5.87 52.3 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.58 ' O ' ' OG ' ' A' ' 43' ' ' SER . 5.8 m120 -84.39 131.6 34.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 49' ' ' LEU . 13.2 tp -83.25 -64.11 1.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.52 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.458 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.1 tt0 -42.34 -21.02 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.691 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -88.0 -45.84 9.86 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.844 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.573 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -55.2 -53.06 60.83 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.726 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 3.9 p -57.19 -62.86 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.558 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.726 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -45.24 -35.22 3.22 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.242 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.7 ' CD2' ' OD1' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -64.35 -30.37 71.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.141 179.027 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.568 ' N ' ' O ' ' A' ' 51' ' ' VAL . 9.3 mt -87.87 -43.83 11.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.387 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.624 ' O ' ' N ' ' A' ' 57' ' ' LYS . 10.2 t -87.27 -29.79 21.38 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.004 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.656 ' CB ' ' O ' ' A' ' 52' ' ' ALA . . . -20.48 -46.74 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.952 0.406 . . . . 0.0 110.859 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -102.85 135.8 43.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.5 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -171.97 -170.16 0.73 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.469 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -156.12 -123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.653 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -103.35 169.71 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.659 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m -164.82 69.83 1.43 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.491 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.665 ' C ' ' H ' ' A' ' 64' ' ' GLN . 72.3 Cg_endo -89.36 -8.94 4.43 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 123.219 2.613 . . . . 0.0 112.096 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -45.95 -6.77 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.649 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.665 ' H ' ' C ' ' A' ' 62' ' ' PRO . 33.2 mt-30 59.46 67.55 0.88 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.511 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.575 ' O ' ' O ' ' A' ' 66' ' ' GLU . 11.7 tt0 -103.78 -83.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.575 ' O ' ' O ' ' A' ' 65' ' ' GLU . 0.5 OUTLIER 53.59 150.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.579 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.81 0.86 2.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.567 ' OG1' ' O ' ' A' ' 68' ' ' THR . 1.5 p 56.0 75.84 0.31 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.556 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.54 ' N ' ' CD1' ' A' ' 69' ' ' TYR . 4.4 p90 -138.43 99.34 3.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.695 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.577 ' O ' ' N ' ' A' ' 72' ' ' THR . 4.0 m-85 -131.7 -65.81 0.74 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.554 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.517 ' C ' ' O ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -30.34 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.604 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.577 ' N ' ' O ' ' A' ' 70' ' ' TYR . 1.6 m -83.91 -59.64 2.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.176 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.57 ' O ' ' O ' ' A' ' 72' ' ' THR . . . 45.13 109.54 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.853 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -131.43 48.42 3.67 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.666 179.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.548 ' O ' ' O ' ' A' ' 76' ' ' GLY . 37.1 Cg_endo -69.88 -18.93 36.17 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.561 2.174 . . . . 0.0 111.836 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.548 ' O ' ' O ' ' A' ' 75' ' ' PRO . . . 25.84 -145.64 0.01 OUTLIER Glycine 0 CA--C 1.523 0.593 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -139.53 116.3 10.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 110.584 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.408 ' O ' ' O ' ' A' ' 79' ' ' ARG . 0.7 OUTLIER -49.06 133.96 17.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.563 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 79' ' ' ARG . 15.2 ttt-85 -61.18 -135.41 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.61 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.467 ' O ' ' O ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -129.76 -163.55 1.31 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.536 -179.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.467 ' O ' ' O ' ' A' ' 80' ' ' TYR . 0.9 OUTLIER 58.3 143.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.721 -179.979 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 83' ' ' VAL . 50.1 p -175.42 -132.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.57 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.475 ' N ' ' OG ' ' A' ' 82' ' ' SER . 1.2 m -86.55 -172.61 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.524 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 111.27 53.33 0.54 Allowed Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 98.6 p -135.82 30.17 3.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.769 0.318 . . . . 0.0 110.659 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -96.64 149.31 21.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.356 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.465 ' O ' ' C ' ' A' ' 88' ' ' ASP . . . -98.15 93.43 6.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.755 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.526 ' O ' ' C ' ' A' ' 89' ' ' THR . 1.9 m-20 -35.21 -61.9 0.41 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.473 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.526 ' C ' ' O ' ' A' ' 88' ' ' ASP . 6.4 m 29.94 52.55 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.543 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -165.22 25.58 0.05 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.4 -166.46 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.854 -179.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.59 ' CG2' ' N ' ' A' ' 93' ' ' ASP . 3.7 tt -170.58 -161.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.571 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.59 ' N ' ' CG2' ' A' ' 92' ' ' ILE . 9.2 m-20 -97.81 125.41 42.64 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.762 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.12 6.89 14.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.04 -29.11 9.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.443 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -79.49 42.96 2.47 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.817 -0.913 . . . . 0.0 110.817 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.84 159.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.64 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 0.3 OUTLIER -85.57 96.05 9.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.41 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.72 -5.78 55.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.66 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -49.36 -20.57 0.69 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -51.62 -49.61 61.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.774 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 104' ' ' ARG . 1.2 tp -71.37 -53.67 13.35 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.15 0.5 . . . . 0.0 110.696 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.421 ' C ' ' O ' ' A' ' 102' ' ' LEU . 26.1 tp60 -43.83 -18.6 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.588 ' N ' ' O ' ' A' ' 102' ' ' LEU . 1.4 mtp180 -86.64 -38.96 16.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.609 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -54.28 -57.78 9.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.398 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.447 ' CD1' ' H ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.64 -57.22 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.756 0.788 . . . . 0.0 109.868 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -44.09 -39.61 4.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.343 -1.299 . . . . 0.0 110.128 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.15 -44.23 92.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.923 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.45 ' C ' ' N ' ' A' ' 111' ' ' ALA . 2.7 t -68.4 -48.34 64.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.51 -17.25 0.76 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.45 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -80.19 -58.85 2.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.039 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -46.82 -25.81 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 115' ' ' ARG . 31.9 t -90.75 -43.31 10.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.864 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.453 ' C ' ' O ' ' A' ' 113' ' ' SER . 34.8 t-20 -37.25 -23.49 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.638 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.648 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -105.75 -45.14 4.47 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.857 179.302 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.455 ' H ' ' HG2' ' A' ' 115' ' ' ARG . . . -79.07 20.95 0.46 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.679 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.493 ' H ' ' C ' ' A' ' 115' ' ' ARG . 53.8 t80 -117.2 -81.59 0.62 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.786 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.26 93.41 0.62 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.648 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -118.31 44.64 2.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.61 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 t -75.98 152.63 36.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.542 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 160.03 56.27 0.01 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 13.6 tt -75.72 134.41 29.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.799 0.333 . . . . 0.0 110.58 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.547 ' O ' ' C ' ' A' ' 124' ' ' ASP . 0.3 OUTLIER -120.95 -15.93 8.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.223 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.547 ' C ' ' O ' ' A' ' 123' ' ' THR . 7.0 p-10 24.06 50.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.9 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 123' ' ' THR . 0.1 OUTLIER -76.1 -41.03 51.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.248 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -39.54 74.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.221 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.513 ' C ' ' CD ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -71.18 -35.71 71.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.907 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.4 -70.98 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.364 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.4 mt -44.68 -39.14 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.4 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 t -55.69 -56.69 17.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.412 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 27.7 ttt-85 -52.3 -51.69 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.05 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.592 ' O ' ' OG ' ' A' ' 136' ' ' SER . 33.2 t -47.46 -71.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.162 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.513 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.1 OUTLIER -30.03 -68.78 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.317 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.657 ' C ' ' H ' ' A' ' 136' ' ' SER . 29.2 tt0 -48.29 -59.85 3.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.717 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.18 4.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.694 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.657 ' H ' ' C ' ' A' ' 134' ' ' GLU . 0.8 OUTLIER -113.65 -22.87 10.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.658 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.448 HG13 ' H ' ' A' ' 138' ' ' ALA . 5.4 pt -108.45 -42.74 5.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.448 ' H ' HG13 ' A' ' 137' ' ' ILE . . . 40.75 51.05 3.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.331 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -89.38 126.95 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.824 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -130.29 -92.67 0.43 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.301 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt 52.36 88.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.717 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -52.79 149.26 6.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.244 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 121.57 10.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.563 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.559 ' O ' ' O ' ' A' ' 145' ' ' LYS . 1.1 mm? -101.58 -53.71 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.532 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.559 ' O ' ' O ' ' A' ' 144' ' ' LEU . 12.3 tttp 53.31 150.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.828 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.491 ' CB ' ' CZ ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.633 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttp . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.779 ' HG1' ' NE2' ' A' ' 5' ' ' GLN . 0.5 OUTLIER -143.2 55.66 1.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.526 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.501 ' C ' ' H ' ' A' ' 5' ' ' GLN . 1.9 p -77.62 88.18 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.299 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 48.44 12.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.97 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.779 ' NE2' ' HG1' ' A' ' 2' ' ' THR . 0.0 OUTLIER -56.25 149.04 17.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.358 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.59 ' C ' ' H ' ' A' ' 8' ' ' LEU . 23.3 t-20 179.4 125.54 0.07 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.674 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -67.72 38.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.582 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.59 ' H ' ' C ' ' A' ' 6' ' ' ASN . 1.5 tp -35.08 -50.57 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.229 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -113.54 121.92 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER -161.55 1.15 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.464 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 p -63.47 -1.48 1.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.556 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 10' ' ' GLN . . . -77.88 -31.53 51.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.363 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.87 -37.03 63.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.652 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.483 ' C ' ' CD ' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.709 -179.778 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -75.74 -34.43 60.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.513 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -68.34 -58.67 4.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.442 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.653 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 8.6 mp0 -54.22 -26.91 31.09 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -64.19 -56.52 14.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.191 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.606 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -75.53 -47.99 24.46 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.331 0.586 . . . . 0.0 110.533 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.606 ' N ' ' CG2' ' A' ' 19' ' ' THR . 61.4 t80 -46.79 -50.56 18.09 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.204 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 54.0 mt -69.33 -52.02 31.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.157 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -45.17 -37.9 4.85 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.635 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.3 mp0 -61.63 -55.72 27.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.881 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.446 ' O ' HG23 ' A' ' 28' ' ' THR . 9.0 mt -45.82 -21.87 0.15 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.256 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -87.9 -23.4 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.137 179.275 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.635 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.6 tt0 -87.53 -58.22 2.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.415 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.82 -59.89 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.444 -177.475 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -84.59 -5.51 59.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 -179.278 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.75 32.6 74.37 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.204 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.477 ' CG2' ' N ' ' A' ' 31' ' ' ASN . 4.4 mm -89.77 161.23 2.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.963 0.382 . . . . 0.0 110.986 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.477 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 23.5 m-20 -125.15 -21.13 4.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.524 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.2 124.68 23.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.532 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m -82.89 -21.96 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.351 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -43.0 19.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.644 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 62.0 mt -60.85 -43.9 96.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.913 0.387 . . . . 0.0 110.459 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' ALA . 75.9 mt -70.26 -56.78 5.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.473 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 0.4 OUTLIER -45.59 -27.07 0.69 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.822 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.473 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -71.43 -39.55 70.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.135 178.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.55 -25.44 65.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.838 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.618 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 1.2 tm? -72.64 -46.38 54.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.104 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.483 ' N ' HD11 ' A' ' 40' ' ' LEU . 19.8 mmmt -58.64 -31.77 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.658 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.86 -48.33 8.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.607 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 44' ' ' ASN . 88.8 p -63.61 -5.91 4.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.679 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.588 ' OD1' ' O ' ' A' ' 44' ' ' ASN . 5.6 p30 59.51 28.6 18.03 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.28 -11.65 54.92 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.687 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.56 ' OD1' ' OD1' ' A' ' 44' ' ' ASN . 10.8 m120 -85.31 131.88 34.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.054 0.427 . . . . 0.0 110.253 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 50' ' ' ALA . 65.7 tp -81.71 -61.29 1.97 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.211 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.418 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.4 mt-10 -40.89 -25.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.055 0.455 . . . . 0.0 109.81 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.707 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.3 mm? -90.05 -35.24 15.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.59 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -63.79 -52.2 61.33 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.632 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 7.5 p -56.64 -56.48 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.77 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -52.71 -36.17 56.92 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.462 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.481 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -54.19 -31.66 53.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.918 178.922 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.545 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -78.68 -55.36 5.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.438 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -81.34 -50.42 9.52 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.223 0.535 . . . . 0.0 109.687 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.77 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 35.11 -157.7 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.335 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.512 ' CB ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER 82.6 82.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.181 -179.356 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 71.7 30.74 2.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.323 -179.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -130.29 -12.48 4.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.021 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.528 ' O ' ' OG1' ' A' ' 61' ' ' THR . 1.7 tttt -53.97 159.68 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.802 0.334 . . . . 0.0 110.577 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.528 ' OG1' ' O ' ' A' ' 60' ' ' LYS . 34.3 m -171.16 75.75 0.53 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.615 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.443 ' HG2' ' H ' ' A' ' 63' ' ' GLN . 72.9 Cg_endo -84.68 -70.0 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 123.066 2.51 . . . . 0.0 112.14 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.604 ' O ' ' C ' ' A' ' 64' ' ' GLN . 39.1 tt0 46.71 93.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.678 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 63' ' ' GLN . 1.3 pt20 7.53 87.55 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.497 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.544 ' CG ' ' N ' ' A' ' 66' ' ' GLU . 52.8 tt0 -56.54 166.34 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.651 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.544 ' N ' ' CG ' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -129.69 88.51 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.661 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 m -104.76 85.53 2.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.5 m -133.49 121.59 22.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.567 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.527 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.2 OUTLIER -120.3 52.27 1.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.151 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.527 ' C ' ' O ' ' A' ' 69' ' ' TYR . 0.2 OUTLIER -28.86 -62.42 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 -179.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.651 ' C ' ' H ' ' A' ' 73' ' ' ALA . 10.9 tt0 -34.61 -66.52 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.248 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 70' ' ' TYR . 3.2 m 66.3 -20.9 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.651 ' H ' ' C ' ' A' ' 71' ' ' GLN . . . 57.35 72.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.484 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.54 68.64 80.66 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.499 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -42.57 -40.05 7.3 Favored 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 122.81 2.34 . . . . 0.0 112.028 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.5 106.47 2.94 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.638 ' ND2' ' N ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -106.92 -7.46 17.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.844 0.354 . . . . 0.0 110.323 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.527 ' O ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -50.69 175.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.694 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.527 ' O ' ' O ' ' A' ' 78' ' ' ASP . 31.2 mtt-85 49.81 110.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.459 ' CD1' ' N ' ' A' ' 80' ' ' TYR . 7.5 m-85 -65.7 -57.32 8.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -127.79 -150.36 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.296 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.433 ' O ' ' CG1' ' A' ' 83' ' ' VAL . 29.0 t -141.61 -75.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.51 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.433 ' CG1' ' O ' ' A' ' 82' ' ' SER . 5.8 m -159.37 124.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.516 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -121.42 -104.28 1.89 Allowed Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.52 -51.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.656 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -95.12 -158.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.652 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.03 93.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.657 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.437 ' O ' ' O ' ' A' ' 89' ' ' THR . 5.3 t0 -82.45 49.82 1.52 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.353 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 88' ' ' ASP . 22.9 m 47.5 97.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.074 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 176.61 37.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.656 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -91.22 -179.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.227 -179.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.61 ' O ' ' CB ' ' A' ' 93' ' ' ASP . 0.3 OUTLIER 179.69 -159.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.802 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.61 ' CB ' ' O ' ' A' ' 92' ' ' ILE . 4.5 t70 90.5 161.29 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.393 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.539 ' H ' ' CD1' ' A' ' 94' ' ' LEU . 4.7 mp -64.61 -31.85 73.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.71 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -25.78 3.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.67 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.43 ' H ' ' HB3' ' A' ' 93' ' ' ASP . . . 53.16 19.01 7.1 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 98' ' ' ASP . 55.1 t0 -73.25 127.14 31.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.89 0.376 . . . . 0.0 110.557 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 34.4 m-20 -66.16 106.07 1.55 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.726 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.5 mtmp? -90.86 -8.77 48.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.477 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.415 ' OD1' ' N ' ' A' ' 100' ' ' ASP . 0.3 OUTLIER -56.55 -42.34 78.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.051 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -82.35 -21.81 35.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.176 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 105' ' ' ALA . 5.1 tt -73.02 -50.08 25.13 Favored 'General case' 0 CA--C 1.51 -0.561 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.1 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -46.01 -20.12 0.08 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.533 ' N ' ' C ' ' A' ' 102' ' ' LEU . 0.8 OUTLIER -87.1 -31.53 20.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.436 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.611 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.1 -57.29 13.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.259 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.47 HD12 ' N ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -74.05 -34.1 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.15 -179.308 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.47 ' N ' HD12 ' A' ' 106' ' ' ILE . . . -61.51 -58.22 9.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.71 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.8 mt -47.27 -44.79 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.781 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.488 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -61.27 -46.2 91.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.056 179.542 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.51 -18.54 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.488 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -82.3 -55.47 4.5 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.533 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.443 ' HA ' ' HE ' ' A' ' 115' ' ' ARG . 69.3 mm-40 -45.95 -22.72 0.22 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.69 ' O ' ' N ' ' A' ' 115' ' ' ARG . 19.1 m -90.4 -49.38 6.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.142 179.251 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.435 ' C ' ' O ' ' A' ' 113' ' ' SER . 6.2 t-20 -36.88 -20.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.994 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.69 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.6 OUTLIER -108.43 -33.84 6.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.49 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.543 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -91.8 6.83 44.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.932 0.396 . . . . 0.0 110.143 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.534 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -85.47 179.86 7.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.488 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.642 ' HE ' ' N ' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -41.88 -33.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.652 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.587 ' O ' ' C ' ' A' ' 120' ' ' THR . 8.3 pt-20 24.19 50.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.863 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 121' ' ' GLY . 0.0 OUTLIER -10.33 -65.36 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.468 179.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . 0.604 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 74.21 162.84 8.94 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 18.2 tt -58.62 165.18 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.74 0.305 . . . . 0.0 110.386 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 p -149.82 91.31 1.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.574 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -120.76 -0.98 10.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.667 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.18 -43.58 70.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.576 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.84 -39.8 62.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.432 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -68.94 -34.08 74.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.68 -70.38 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.768 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.0 pp -39.49 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.798 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.1 m -72.43 -78.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.899 0.381 . . . . 0.0 110.89 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.583 ' CA ' ' HE ' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -25.74 -56.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.324 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.74 ' CG1' ' H ' ' A' ' 133' ' ' LEU . 7.2 p -57.72 -69.72 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.345 -179.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.74 ' H ' ' CG1' ' A' ' 132' ' ' VAL . 0.5 OUTLIER -42.34 -54.19 3.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.811 0.338 . . . . 0.0 110.654 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.459 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 34.2 mm-40 -41.18 -51.5 3.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.598 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.6 -23.58 59.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 133' ' ' LEU . 74.6 m -86.2 -77.81 0.3 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.816 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.422 HG21 ' N ' ' A' ' 138' ' ' ALA . 14.3 tt -43.87 -40.88 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.861 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 134' ' ' GLU . . . -65.28 82.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.916 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -71.03 132.53 45.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.326 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.82 143.67 44.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.586 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -124.63 123.77 40.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.77 -27.42 22.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.468 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 6.0 t 54.86 -152.6 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.678 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 15.2 tp 68.08 52.64 0.67 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.791 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -116.69 24.95 10.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.267 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.5 ttt-85 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.549 -179.891 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ptm . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.579 ' O ' ' N ' ' A' ' 4' ' ' GLU . 2.0 m -103.68 -10.5 18.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.61 ' O ' ' C ' ' A' ' 4' ' ' GLU . 9.8 p 23.24 45.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.059 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.61 ' C ' ' O ' ' A' ' 3' ' ' VAL . 3.5 mt-10 5.1 79.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.582 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.429 ' C ' ' OD1' ' A' ' 6' ' ' ASN . 0.5 OUTLIER -65.58 -118.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.948 0.404 . . . . 0.0 110.68 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.429 ' OD1' ' C ' ' A' ' 5' ' ' GLN . 4.4 p-10 172.7 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.431 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 8.3 m -131.38 -45.04 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.559 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 177.87 134.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.565 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.3 67.59 4.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.533 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.54 ' O ' ' C ' ' A' ' 11' ' ' SER . 2.2 pt20 -51.47 162.13 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.814 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.54 ' C ' ' O ' ' A' ' 10' ' ' GLN . 2.8 p 24.11 85.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.13 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.48 -21.4 35.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.863 0.363 . . . . 0.0 110.269 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.63 -47.05 70.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.317 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -50.72 -23.32 2.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.566 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -63.59 -18.99 64.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.513 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -56.88 -54.49 45.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.663 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.09 -45.25 61.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.29 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -46.65 -50.95 16.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.397 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.576 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -72.6 -49.33 32.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.194 0.521 . . . . 0.0 110.872 -179.62 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.576 ' N ' ' CG2' ' A' ' 19' ' ' THR . 35.1 t80 -46.46 -58.91 3.32 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.9 mt -66.26 -49.84 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.217 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -45.54 -40.35 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 26' ' ' GLU . 13.2 mm-40 -61.46 -50.09 74.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.765 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.448 ' O ' ' CG2' ' A' ' 28' ' ' THR . 29.9 mt -44.28 -30.95 0.89 Allowed 'General case' 0 C--O 1.226 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.132 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.49 ' CD ' ' C ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -84.59 -18.99 33.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.08 0.467 . . . . 0.0 110.031 179.232 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.674 ' N ' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -87.4 -55.03 3.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.674 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.437 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -62.27 -59.58 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -177.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.448 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -89.15 -3.72 58.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.577 -178.088 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.43 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 66.08 32.68 83.15 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.304 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.404 HG12 ' OG1' ' A' ' 28' ' ' THR . 39.5 mm -106.97 107.48 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 117.449 0.625 . . . . 0.0 110.945 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.659 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -79.91 -20.11 46.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.678 -179.474 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -44.51 84.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.224 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.659 ' N ' ' O ' ' A' ' 31' ' ' ASN . 8.6 t -51.79 -24.47 6.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.866 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.473 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.67 -40.65 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.187 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.473 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 10.7 mt -75.36 -29.41 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.086 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.479 HD22 ' N ' ' A' ' 36' ' ' LEU . 3.2 mt -70.2 -44.81 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.527 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.422 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 2.7 pt20 -64.19 -28.75 69.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.386 . . . . 0.0 110.147 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 46.6 tt0 -79.59 -38.29 34.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.05 69.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.503 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.62 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -77.06 -40.33 46.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.127 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.485 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.64 -35.64 70.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.632 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.7 OUTLIER -86.09 -46.23 10.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.034 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.623 ' O ' ' N ' ' A' ' 45' ' ' GLY . 5.8 m -66.26 18.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.962 0.41 . . . . 0.0 111.01 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.723 HD22 ' ND2' ' A' ' 46' ' ' ASN . 0.8 OUTLIER 31.77 28.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.108 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.623 ' N ' ' O ' ' A' ' 43' ' ' SER . . . 97.5 26.53 9.89 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.945 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.723 ' ND2' HD22 ' A' ' 44' ' ' ASN . 12.7 m-80 -108.68 131.0 55.34 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.452 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -78.56 -63.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.728 -177.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.424 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 52.4 tt0 -49.13 -20.83 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.732 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.1 mm? -89.44 -52.57 4.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.486 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.551 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -53.81 -47.77 70.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.629 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 6.5 p -62.96 -50.71 78.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.119 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.709 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -60.33 -28.72 68.37 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.669 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.482 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.7 OUTLIER -61.91 -37.16 83.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.048 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.551 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -71.4 -57.62 4.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.605 ' O ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -82.11 -50.58 8.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.936 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.709 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 34.61 26.67 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.884 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -167.85 -34.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.813 0.34 . . . . 0.0 110.492 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.492 ' N ' ' OG1' ' A' ' 55' ' ' THR . 2.1 t-20 -89.57 -145.99 0.17 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.819 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 58' ' ' ASN . . . 75.92 102.84 0.07 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.629 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.407 ' H ' ' HG3' ' A' ' 60' ' ' LYS . 0.4 OUTLIER -121.07 -68.19 0.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.115 -179.693 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.706 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 0.1 OUTLIER -140.78 -42.66 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.332 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.998 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.706 ' CD ' ' H ' ' A' ' 61' ' ' THR . 9.2 Cg_endo -86.44 56.57 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.193 2.595 . . . . 0.0 111.75 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -130.82 15.04 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.677 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -138.33 48.36 1.95 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.436 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -80.31 172.53 13.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.607 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.545 ' C ' ' HG1' ' A' ' 67' ' ' THR . 20.1 mp0 -100.41 131.86 46.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.817 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.545 ' HG1' ' C ' ' A' ' 66' ' ' GLU . 3.2 m -156.12 127.73 7.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.293 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.6 p -120.32 158.33 27.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.681 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.542 ' CE1' ' O ' ' A' ' 70' ' ' TYR . 18.1 t80 179.65 130.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.473 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.548 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -125.45 -174.3 3.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.67 -179.861 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.461 ' O ' ' OE2' ' A' ' 4' ' ' GLU . 1.8 tp-100 -103.49 140.82 36.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.464 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.5 p -155.45 124.08 6.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.637 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -175.13 160.88 2.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.322 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.528 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.5 OUTLIER -151.98 49.07 0.51 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.792 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 30.8 Cg_endo -65.9 -9.98 25.15 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.857 2.371 . . . . 0.0 112.2 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -42.03 96.58 0.01 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 75' ' ' PRO . 2.8 t-20 -86.73 163.06 17.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.801 0.334 . . . . 0.0 110.785 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 79' ' ' ARG . 4.8 t0 -169.88 134.28 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.633 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.633 ' O ' ' CG ' ' A' ' 80' ' ' TYR . 0.0 OUTLIER -138.57 -173.78 3.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.282 179.796 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.633 ' CG ' ' O ' ' A' ' 79' ' ' ARG . 87.6 m-85 -163.01 165.07 25.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.191 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.9 mt 66.46 87.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.433 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 54.7 p -135.03 93.32 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.4 m -47.99 129.03 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.455 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -164.57 55.05 0.27 Allowed Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.65 29.98 6.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.35 . . . . 0.0 110.383 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 70.38 -142.47 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.541 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 179.8 130.21 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.706 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.549 ' O ' ' C ' ' A' ' 89' ' ' THR . 24.4 t0 -162.87 47.09 0.14 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.62 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.549 ' C ' ' O ' ' A' ' 88' ' ' ASP . 3.1 t 24.58 51.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.413 ' N ' ' O ' ' A' ' 88' ' ' ASP . 2.3 t-20 -174.25 40.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.231 0.538 . . . . 0.0 109.652 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.591 ' O ' ' O ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -115.14 -60.6 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.449 -178.821 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.591 ' O ' ' O ' ' A' ' 91' ' ' VAL . 1.9 tt -49.13 -161.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.349 0.595 . . . . 0.0 111.206 -178.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.577 ' O ' ' O ' ' A' ' 92' ' ' ILE . 11.0 m-20 -27.75 152.1 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.916 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.03 -38.4 10.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.475 HG22 ' H ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -74.25 -62.95 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.534 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.475 ' H ' HG22 ' A' ' 95' ' ' THR . . . 75.18 78.5 0.63 Allowed Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -68.5 91.26 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.753 0.311 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -117.15 96.13 5.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.631 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.19 -14.38 31.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.632 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.22 -20.6 65.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.761 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -87.83 -44.72 10.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.781 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.649 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.3 mt -66.67 -51.84 51.61 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.012 0.434 . . . . 0.0 110.693 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 102' ' ' LEU . 0.7 OUTLIER -43.82 -18.85 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.6 ' N ' ' O ' ' A' ' 102' ' ' LEU . 3.5 ttp180 -86.76 -35.45 19.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.166 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.649 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -67.39 -47.99 68.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.117 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.83 -32.81 59.67 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.214 0.531 . . . . 0.0 110.451 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.81 -52.6 23.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.451 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 63.1 tp -46.33 -53.0 11.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.644 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.483 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER -63.79 -46.68 84.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.421 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.04 -17.46 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.483 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -86.95 -58.42 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.782 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -46.23 -22.4 0.23 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.86 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.672 ' O ' ' N ' ' A' ' 115' ' ' ARG . 8.6 t -90.04 -50.78 5.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.502 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -39.18 -18.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.975 179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.672 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -105.14 -39.65 6.14 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -89.64 31.06 0.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.131 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -125.67 172.08 10.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.833 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.55 ' O ' ' C ' ' A' ' 119' ' ' GLU . 1.8 ptp85 166.29 -43.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.962 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.55 ' C ' ' O ' ' A' ' 118' ' ' ARG . 1.7 tt0 23.26 60.67 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.033 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.471 ' HG1' ' N ' ' A' ' 121' ' ' GLY . 2.7 t -75.82 155.6 35.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . 0.471 ' N ' ' HG1' ' A' ' 120' ' ' THR . . . -113.33 -167.64 16.72 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 15.1 tt -140.49 132.91 32.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.556 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.499 ' O ' ' CG ' ' A' ' 124' ' ' ASP . 5.3 m -56.72 -65.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.624 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.499 ' CG ' ' O ' ' A' ' 123' ' ' THR . 2.4 m-20 174.41 38.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.327 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 -22.34 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.632 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.03 -53.12 42.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.74 -39.26 90.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.543 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -63.16 -69.37 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.484 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 128' ' ' ALA . 5.0 mm -37.86 -48.34 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.696 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -60.72 2.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 131' ' ' ARG . 3.9 mmt180 -59.08 -55.77 30.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' A' ' 135' ' ' ALA . 82.9 t -48.02 -66.39 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.425 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.469 ' C ' ' O ' ' A' ' 132' ' ' VAL . 5.3 tt -34.57 -48.87 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.631 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.551 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -62.51 -30.89 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.5 m -80.55 -16.21 54.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.692 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.527 ' O ' ' C ' ' A' ' 138' ' ' ALA . 4.5 mm -93.27 -20.62 6.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.757 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.527 ' C ' ' O ' ' A' ' 137' ' ' ILE . . . -29.58 -69.31 0.06 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.353 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.4 ' C ' HD21 ' A' ' 140' ' ' ASN . 0.6 OUTLIER -115.59 32.62 5.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.288 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.4 HD21 ' C ' ' A' ' 139' ' ' GLU . 1.5 m-80 55.8 -130.27 1.91 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.419 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.06 118.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.477 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -160.34 26.9 0.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.213 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.61 ' O ' ' N ' ' A' ' 145' ' ' LYS . 0.8 OUTLIER 51.48 -167.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.315 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.472 ' C ' ' O ' ' A' ' 143' ' ' CYS . 1.4 mm? 34.27 28.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.62 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 143' ' ' CYS . 0.6 OUTLIER -77.34 152.16 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.291 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.4 mtm180 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.505 179.942 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tmm? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.614 ' O ' ' N ' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -129.94 -78.77 0.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.641 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.548 ' C ' ' O ' ' A' ' 2' ' ' THR . 6.3 p 24.3 41.55 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.006 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.614 ' N ' ' O ' ' A' ' 2' ' ' THR . 30.8 tt0 -52.15 143.66 13.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.382 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.408 ' C ' ' O ' ' A' ' 4' ' ' GLU . 19.1 tp60 -39.35 129.25 1.8 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.457 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -138.84 73.43 1.43 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.837 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.0 m -108.77 5.32 9.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.511 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.49 -21.94 57.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.58 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -80.39 89.73 5.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -69.14 -164.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.572 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.3 32.52 0.52 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.37 -42.86 29.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.5 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.35 -19.5 64.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.583 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -48.35 -33.73 9.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.003 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -89.26 -51.92 5.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.92 -60.32 1.99 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -84.51 -60.87 1.94 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.763 -177.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -46.8 -32.4 3.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.385 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.603 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -69.37 -49.83 51.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.461 0.648 . . . . 0.0 110.081 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.603 ' N ' ' CG2' ' A' ' 19' ' ' THR . 74.9 t80 -60.1 -49.52 77.31 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.604 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -39.55 89.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.16 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -59.25 -39.37 82.63 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.472 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.613 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.9 mm100 -56.83 -51.64 68.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.138 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.493 ' O ' ' CG2' ' A' ' 28' ' ' THR . 4.5 mt -45.75 -41.26 10.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.332 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.661 ' NH2' ' OE1' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -69.7 -18.45 63.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.717 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.661 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 1.3 tp10 -85.89 -58.43 2.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -64.43 -59.41 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.493 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -83.24 -2.91 56.77 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.501 -178.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 62.7 20.23 61.54 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.032 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.537 ' CG2' ' N ' ' A' ' 31' ' ' ASN . 9.1 mm -65.62 160.36 3.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 117.094 0.447 . . . . 0.0 110.628 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 5.6 t-20 -117.12 -56.92 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.298 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -48.53 111.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.621 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.2 p -71.99 -19.88 61.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.728 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -70.65 -43.08 69.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.594 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.9 mt -62.05 -40.85 88.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.554 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.558 ' O ' ' N ' ' A' ' 39' ' ' ALA . 16.3 mt -60.45 -62.1 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.451 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -43.41 -28.05 0.32 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' N ' ' C ' ' A' ' 36' ' ' LEU . 2.1 tp60 -76.09 -38.96 56.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.854 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.558 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.42 -38.07 84.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.075 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.612 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -62.29 -37.26 84.85 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.405 ' HB2' ' HZ3' ' A' ' 41' ' ' LYS . 0.1 OUTLIER -59.9 -43.38 94.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.067 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -78.67 -46.07 19.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.147 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.6 p -66.63 -31.57 72.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.307 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 67.3 47.08 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.728 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.473 ' H ' HD21 ' A' ' 40' ' ' LEU . . . 94.15 -14.33 65.52 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.02 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -80.12 124.94 29.21 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 49' ' ' LEU . 32.8 tp -85.02 -62.7 1.48 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.324 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' A' ' 47' ' ' LEU . 3.7 tt0 -42.44 -20.87 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.635 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 4.0 mm? -86.3 -50.19 7.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.608 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -58.2 -56.82 17.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.647 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 3.7 p -49.67 -46.89 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.692 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -60.08 -36.29 77.04 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.401 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -64.39 -36.13 83.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.253 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.484 ' N ' HD21 ' A' ' 54' ' ' LEU . 4.4 mm? -69.34 -57.49 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.179 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.538 ' O ' ' C ' ' A' ' 56' ' ' ALA . 9.9 t -79.29 -48.5 14.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.391 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.692 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 30.27 -129.67 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.049 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.39 -163.53 0.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.547 ' ND2' ' H ' ' A' ' 59' ' ' ALA . 8.8 t-20 -178.7 163.48 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.857 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.547 ' H ' ' ND2' ' A' ' 58' ' ' ASN . . . 67.65 61.08 0.45 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.949 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.533 ' HG2' ' N ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -121.05 -34.07 3.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.103 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.533 ' N ' ' HG2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER 167.97 86.6 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.074 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.651 ' C ' ' H ' ' A' ' 64' ' ' GLN . 57.5 Cg_endo -88.58 -153.56 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 123.146 2.564 . . . . 0.0 111.8 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 61.71 -9.75 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.82 0.343 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.651 ' H ' ' C ' ' A' ' 62' ' ' PRO . 7.6 mm100 -136.87 56.93 1.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -136.69 130.13 31.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.524 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -162.13 111.08 1.45 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.382 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.573 ' O ' ' OG1' ' A' ' 68' ' ' THR . 3.9 t -44.25 110.22 0.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.533 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.573 ' OG1' ' O ' ' A' ' 67' ' ' THR . 11.4 m -178.78 -57.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.724 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 61.35 100.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.271 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -73.99 -176.83 2.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.659 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -91.98 133.66 35.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.381 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 5.1 p -128.24 -28.84 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.3 135.43 57.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.515 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.535 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -125.71 49.58 3.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.504 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 26.9 Cg_endo -65.66 64.03 0.4 Allowed 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.69 2.26 . . . . 0.0 112.067 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.523 ' C ' ' O ' ' A' ' 75' ' ' PRO . . . -28.67 118.14 0.06 OUTLIER Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.931 -0.867 . . . . 0.0 110.931 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.611 HD22 HH21 ' A' ' 79' ' ' ARG . 29.3 t30 -116.95 113.79 22.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.625 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -98.86 130.25 45.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.32 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.682 ' C ' ' H ' ' A' ' 81' ' ' ILE . 3.5 ttm180 -155.84 -34.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.568 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 64.57 -28.71 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.633 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.682 ' H ' ' C ' ' A' ' 79' ' ' ARG . 0.1 OUTLIER -158.72 -176.06 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.29 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.527 ' O ' ' C ' ' A' ' 83' ' ' VAL . 5.0 m -121.8 -173.88 2.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.627 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.527 ' C ' ' O ' ' A' ' 82' ' ' SER . 90.0 t -29.13 111.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.569 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.618 ' C ' ' H ' ' A' ' 86' ' ' GLN . . . -59.41 -49.35 79.51 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.21 -10.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.846 0.355 . . . . 0.0 110.496 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.618 ' H ' ' C ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -150.28 165.29 33.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.459 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.05 127.88 33.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.586 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -101.47 -16.82 16.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.748 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 t -49.57 161.66 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.512 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -179.49 29.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.316 0.579 . . . . 0.0 109.718 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.465 ' O ' ' CB ' ' A' ' 92' ' ' ILE . 0.4 OUTLIER -86.46 167.92 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.857 -179.482 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.645 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 1.3 tt 163.23 165.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.749 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.645 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -105.43 143.05 34.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.791 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.9 pp -123.07 -33.75 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.667 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.9 t -94.74 -13.35 25.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.585 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.488 ' O ' ' CB ' ' A' ' 97' ' ' ASP . . . 105.83 -12.7 45.96 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.488 ' CB ' ' O ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER 162.26 -83.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.667 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -88.01 149.21 24.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -84.11 -12.78 54.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.536 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -68.78 -21.39 64.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.594 ' OD2' ' NH2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -54.59 -17.4 3.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.573 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.576 ' CD1' ' C ' ' A' ' 102' ' ' LEU . 0.2 OUTLIER -60.57 -35.45 76.09 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 120.53 -0.468 . . . . 0.0 109.793 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.461 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.6 OUTLIER -56.25 -18.69 11.18 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.594 ' NH2' ' OD2' ' A' ' 101' ' ' ASP . 0.4 OUTLIER -82.38 -37.91 24.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.652 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.82 -49.02 76.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.98 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.505 HG22 HD11 ' A' ' 106' ' ' ILE . 1.3 mm -62.25 -40.95 89.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 109.75 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.0 -48.15 76.41 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.526 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.2 tp -55.89 -34.51 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.824 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.462 ' C ' ' N ' ' A' ' 111' ' ' ALA . 58.2 m -78.07 -49.69 13.48 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.575 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.06 -18.29 0.18 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.462 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.86 -58.25 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.457 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -46.25 -26.29 0.77 Allowed 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.583 ' O ' ' N ' ' A' ' 115' ' ' ARG . 35.9 t -85.21 -43.77 13.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.987 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 113' ' ' SER . 2.8 t-20 -42.42 -18.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.583 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -102.85 -44.65 5.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.24 179.59 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.07 11.24 4.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.168 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.471 ' CD2' ' HG3' ' A' ' 118' ' ' ARG . 32.4 t80 -87.51 -104.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.618 ' O ' ' N ' ' A' ' 120' ' ' THR . 52.6 mtt180 -82.97 40.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.795 0.331 . . . . 0.0 110.481 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 118' ' ' ARG . 3.7 pt-20 23.73 42.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.126 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.618 ' N ' ' O ' ' A' ' 118' ' ' ARG . 1.8 p -47.09 169.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.295 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -164.39 27.36 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.7 tp -42.42 157.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 16.8 p -135.75 151.92 50.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.629 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.03 -84.0 0.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.96 -47.95 80.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.605 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 130' ' ' SER . 1.5 tt0 -53.26 -34.22 56.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.598 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.497 ' O ' ' OG ' ' A' ' 130' ' ' SER . 16.6 tt0 -65.91 -55.86 14.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.783 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -45.16 -64.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.446 ' N ' HD13 ' A' ' 129' ' ' ILE . 1.6 mp -43.9 -39.36 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.525 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.31 -44.27 83.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 7.6 tpt180 -50.33 -36.16 30.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.579 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.9 t -75.37 -62.91 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.49 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.9 mt -44.6 -42.94 7.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -51.57 56.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -74.84 5.61 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.018 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.4 4.08 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.83 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.6 ' O ' ' O ' ' A' ' 138' ' ' ALA . 6.5 tt -145.45 10.84 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 110.761 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.6 ' O ' ' O ' ' A' ' 137' ' ' ILE . . . 21.92 104.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 140' ' ' ASN . 3.9 tp10 -115.4 143.74 44.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.465 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.491 ' CG ' ' H ' ' A' ' 141' ' ' LYS . 33.0 t-20 -132.96 -138.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.684 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.497 ' O ' ' C ' ' A' ' 142' ' ' ALA . 9.1 tttp -149.97 106.78 3.54 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.763 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.497 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . -31.7 109.39 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.729 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 3.2 t -109.35 6.89 24.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 18.5 mt 66.09 142.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.517 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.0 -153.6 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.398 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.627 -179.975 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mpt? . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.55 ' O ' ' NE2' ' A' ' 5' ' ' GLN . 9.1 t -174.28 -36.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.849 0.357 . . . . 0.0 110.472 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -82.01 47.54 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.542 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.539 ' O ' ' O ' ' A' ' 5' ' ' GLN . 1.4 tt0 -108.6 -82.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.969 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.642 ' O ' ' ND2' ' A' ' 6' ' ' ASN . 23.0 mm-40 52.55 161.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 5' ' ' GLN . 55.6 m-80 -168.1 88.69 0.25 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.46 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 50.4 t -128.72 153.45 38.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.514 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.583 ' O ' ' C ' ' A' ' 9' ' ' GLN . 2.1 tt -165.67 163.33 19.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.583 ' C ' ' O ' ' A' ' 8' ' ' LEU . 0.7 OUTLIER -21.9 -64.65 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.115 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.453 ' CG ' ' O ' ' A' ' 8' ' ' LEU . 4.1 mm-40 40.88 -133.14 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.583 ' HG ' ' H ' ' A' ' 12' ' ' ALA . 87.4 p -156.74 -66.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.953 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.583 ' H ' ' HG ' ' A' ' 11' ' ' SER . . . -54.93 -14.24 1.4 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.158 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -42.53 -19.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.874 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' ALA . 40.1 mt-30 -70.61 -40.27 73.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.849 0.357 . . . . 0.0 110.362 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.428 ' N ' ' O ' ' A' ' 12' ' ' ALA . 21.4 ttmt -78.6 -18.78 54.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.719 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.27 -20.85 66.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.963 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.436 ' HG2' ' N ' ' A' ' 18' ' ' GLN . 2.4 pt20 -45.37 -39.68 7.12 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.048 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.436 ' N ' ' HG2' ' A' ' 17' ' ' GLN . 5.1 mm-40 -47.13 -56.04 7.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.451 HG22 ' N ' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -72.54 -40.43 66.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.159 0.504 . . . . 0.0 110.326 179.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.451 ' N ' HG22 ' A' ' 19' ' ' THR . 36.7 t80 -45.47 -63.64 0.91 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.809 179.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.8 mt -55.97 -45.12 79.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.253 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 3.4 t-20 -48.56 -43.69 35.85 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.461 0.648 . . . . 0.0 109.43 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.734 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.5 mm100 -60.64 -55.79 29.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.438 ' HB3' ' CD1' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -43.8 -19.3 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.768 179.612 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -85.31 -25.29 27.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.734 ' N ' ' O ' ' A' ' 23' ' ' GLN . 15.0 tt0 -87.06 -58.14 2.7 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.378 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.748 ' CD1' ' H ' ' A' ' 27' ' ' ILE . 2.4 mp -53.54 -60.7 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -88.53 -3.12 58.87 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.663 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.13 32.89 62.59 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.532 HG21 ' H ' ' A' ' 32' ' ' ASP . 27.9 mm -81.58 162.16 3.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.191 0.52 . . . . 0.0 111.725 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.425 ' N ' HG21 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -151.27 33.66 0.58 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.525 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.532 ' H ' HG21 ' A' ' 30' ' ' ILE . 24.6 m-20 -111.6 142.81 43.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.325 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 m -83.03 -39.32 21.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.666 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -78.92 -52.05 8.82 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.454 ' H ' HG12 ' A' ' 35' ' ' ILE . 8.1 mm -57.11 -25.17 22.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -83.69 -26.68 29.61 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.516 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -81.64 -18.35 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -85.16 -32.24 22.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.513 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.421 ' O ' ' N ' ' A' ' 43' ' ' SER . . . -74.12 -50.19 20.54 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.93 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.0 -41.41 83.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.797 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -61.95 -36.38 81.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.165 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.577 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 1.1 t0 -86.6 -20.16 28.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.152 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.556 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -82.96 -30.36 28.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.898 -179.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.498 ' N ' ' ND2' ' A' ' 44' ' ' ASN . 0.2 OUTLIER 72.9 34.21 1.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.977 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.49 2.15 68.06 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.556 ' O ' ' OG ' ' A' ' 43' ' ' SER . 3.0 m120 -96.61 126.06 41.52 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -79.75 -64.02 1.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.54 -177.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.446 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 31.8 tt0 -43.2 -21.44 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.705 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.0 mm? -88.05 -43.83 11.41 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.689 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.567 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -60.21 -55.13 37.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.688 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 7.4 p -54.53 -57.34 6.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 121.856 0.836 . . . . 0.0 109.063 178.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.738 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -49.86 -42.09 46.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.875 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -52.09 -32.32 34.49 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.626 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.567 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.8 mp -74.44 -57.74 3.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.128 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.21 -50.71 12.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.348 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.738 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -50.35 169.24 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.089 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -117.87 -20.23 8.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.057 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.73 -151.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.345 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -168.08 126.59 1.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.962 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -118.77 -138.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.488 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.454 ' N ' ' HD3' ' A' ' 62' ' ' PRO . 20.0 p -147.09 65.27 9.53 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 121.127 0.489 . . . . 0.0 110.684 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.656 ' C ' ' H ' ' A' ' 64' ' ' GLN . 72.9 Cg_endo -87.29 -91.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 123.524 2.816 . . . . 0.0 112.114 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 61.81 -17.79 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.287 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.663 ' N ' HE21 ' A' ' 64' ' ' GLN . 0.0 OUTLIER 50.63 54.41 11.24 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.238 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.563 ' C ' ' O ' ' A' ' 64' ' ' GLN . 52.2 tp10 -22.05 107.74 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.951 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.502 ' OE1' ' OG1' ' A' ' 68' ' ' THR . 2.4 tt0 -151.33 150.38 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.805 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.447 ' N ' ' HG2' ' A' ' 66' ' ' GLU . 0.1 OUTLIER -113.86 118.77 35.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.396 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.502 ' OG1' ' OE1' ' A' ' 66' ' ' GLU . 0.3 OUTLIER -137.06 -153.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.627 -179.859 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.677 ' CD2' ' O ' ' A' ' 70' ' ' TYR . 19.3 p90 -166.81 143.39 4.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.549 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.677 ' O ' ' CD2' ' A' ' 69' ' ' TYR . 75.0 m-85 -57.82 -160.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.569 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -123.8 -15.05 7.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.6 m 43.2 66.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.388 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.12 -174.1 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.53 ' N ' ' HD3' ' A' ' 75' ' ' PRO . 0.7 OUTLIER -141.86 59.85 10.22 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.647 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.53 ' HD3' ' N ' ' A' ' 74' ' ' LEU . 7.3 Cg_exo -66.33 -1.89 6.24 Favored 'Trans proline' 0 C--N 1.302 -1.88 0 C-N-CA 122.37 2.047 . . . . 0.0 112.058 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.9 99.36 2.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.605 ' O ' ' CB ' ' A' ' 78' ' ' ASP . 5.2 t-20 -84.19 104.85 14.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.765 0.316 . . . . 0.0 110.526 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.605 ' CB ' ' O ' ' A' ' 77' ' ' ASN . 10.6 t0 89.11 58.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.449 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.515 ' O ' ' O ' ' A' ' 80' ' ' TYR . 1.2 mmt85 -158.93 102.02 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.662 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.515 ' O ' ' O ' ' A' ' 79' ' ' ARG . 5.6 m-85 56.1 143.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.78 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER 64.55 56.51 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.545 ' O ' ' C ' ' A' ' 83' ' ' VAL . 3.4 t -60.55 138.14 58.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.458 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.545 ' C ' ' O ' ' A' ' 82' ' ' SER . 8.6 p -25.94 137.81 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.756 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -92.82 -90.66 1.52 Allowed Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.17 25.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.707 0.289 . . . . 0.0 110.603 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.525 ' O ' ' CB ' ' A' ' 87' ' ' ALA . 25.1 mt-30 -42.17 154.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.28 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.525 ' CB ' ' O ' ' A' ' 86' ' ' GLN . . . 160.14 79.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.725 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -73.6 -2.48 23.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.319 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 120.05 18.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.595 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.44 ' O ' ' ND2' ' A' ' 90' ' ' ASN . 20.7 t30 -178.78 35.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.169 0.509 . . . . 0.0 109.701 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -115.26 157.78 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.343 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.569 ' CG2' ' N ' ' A' ' 93' ' ' ASP . 0.2 OUTLIER 179.47 -159.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.528 178.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.569 ' N ' ' CG2' ' A' ' 92' ' ' ILE . 5.8 m-20 -134.47 113.89 12.31 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.863 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -9.23 58.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.486 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.661 ' C ' ' H ' ' A' ' 97' ' ' ASP . 0.1 OUTLIER -131.63 -56.26 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.588 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.409 ' H ' HG23 ' A' ' 95' ' ' THR . . . 65.2 -27.87 0.12 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.661 ' H ' ' C ' ' A' ' 95' ' ' THR . 0.0 OUTLIER 179.71 135.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.737 0.303 . . . . 0.0 110.49 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.13 86.45 2.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.46 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -19.64 22.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.102 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.67 -26.78 60.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.607 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.532 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 6.1 t70 -69.28 -54.11 16.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.421 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.63 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.6 OUTLIER -57.56 -47.87 80.88 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.145 0.497 . . . . 0.0 110.051 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -44.98 -19.8 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.566 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.3 ttt180 -82.76 -37.86 24.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.768 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.63 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.9 -54.77 40.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.56 -36.41 77.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 121.371 0.605 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.9 94.77 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.44 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.21 -45.97 86.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.408 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.9 OUTLIER -66.83 -55.88 12.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.277 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 18.4 tp -47.62 -17.9 0.12 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.524 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -76.27 -58.29 3.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.597 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -49.9 -21.28 1.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.624 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -88.36 -52.83 4.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.868 179.402 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -43.86 -13.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.624 ' H ' ' C ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -101.31 -40.67 7.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.838 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.485 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -75.88 -14.74 60.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.804 179.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.436 ' O ' ' C ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -66.65 -62.05 1.66 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.217 179.751 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.624 ' C ' ' H ' ' A' ' 120' ' ' THR . 9.9 mtp180 -36.36 -80.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 60.74 -6.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.462 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.624 ' H ' ' C ' ' A' ' 118' ' ' ARG . 26.6 p -41.01 136.74 1.41 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.55 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 135.64 80.97 0.12 Allowed Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.471 HG12 ' H ' ' A' ' 123' ' ' THR . 11.9 tt -167.59 176.12 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 0.0 110.484 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.471 ' H ' HG12 ' A' ' 122' ' ' ILE . 0.7 OUTLIER 53.22 50.11 18.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.585 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.36 118.95 9.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.423 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.48 -38.02 17.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.933 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.8 -35.34 69.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.882 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -81.62 -35.48 30.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.676 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -71.09 -39.18 72.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.876 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.1 mm -78.0 -40.28 26.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.821 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.5 t -73.7 -22.02 60.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -56.9 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.583 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.2 p -56.92 -37.54 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.596 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -63.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.456 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 134' ' ' GLU . 0.4 OUTLIER -45.63 -50.51 13.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.439 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.14 -42.52 66.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.675 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 6.6 m -70.26 -72.22 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.458 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 2.0 pt -50.76 -22.66 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.372 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 134' ' ' GLU . . . 66.51 -162.76 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.526 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -90.34 93.89 9.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.521 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -148.69 114.48 5.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.281 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.681 ' O ' ' N ' ' A' ' 143' ' ' CYS . 2.7 mttp -98.52 -81.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.465 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.455 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . 35.58 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.562 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.681 ' N ' ' O ' ' A' ' 141' ' ' LYS . 0.7 OUTLIER -163.27 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.461 179.887 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.458 HD21 ' N ' ' A' ' 145' ' ' LYS . 0.9 OUTLIER -178.47 -3.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.376 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.458 ' N ' HD21 ' A' ' 144' ' ' LEU . 8.0 mtpp 57.98 -179.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.661 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.622 -179.943 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.562 ' O ' ' OG1' ' A' ' 2' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.643 ' C ' ' H ' ' A' ' 4' ' ' GLU . 20.3 p 60.98 89.66 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.646 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.506 ' O ' ' C ' ' A' ' 4' ' ' GLU . 4.9 p -52.91 -0.1 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.964 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.643 ' H ' ' C ' ' A' ' 2' ' ' THR . 2.9 mm-40 -32.17 109.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.545 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.17 74.65 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.75 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -47.08 137.9 7.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.66 147.0 31.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.648 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -85.03 -5.64 59.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.329 179.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' C ' ' H ' ' A' ' 11' ' ' SER . 25.0 tp60 -86.59 15.01 5.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.315 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.404 ' H ' ' HG3' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -69.76 6.25 1.22 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.526 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.465 ' H ' ' C ' ' A' ' 9' ' ' GLN . 19.3 p -132.53 65.88 1.57 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.77 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.46 ' HB3' ' HZ2' ' A' ' 15' ' ' LYS . . . -62.37 -23.02 66.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.294 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.42 -19.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.818 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 12' ' ' ALA . 1.8 mm100 -47.92 -42.31 26.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.46 ' HZ2' ' HB3' ' A' ' 12' ' ' ALA . 8.0 ptpp? -84.51 -18.58 35.31 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.706 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.402 ' C ' ' N ' ' A' ' 18' ' ' GLN . 0.2 OUTLIER -88.17 -25.98 22.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.314 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.721 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 1.3 pm0 -45.13 -24.6 0.26 Allowed 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.215 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.662 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 77.4 mt-30 -53.82 -41.47 67.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.517 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -81.06 -44.78 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.148 0.499 . . . . 0.0 110.564 -179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.486 ' CD1' ' CD1' ' A' ' 40' ' ' LEU . 12.4 t80 -48.79 -60.68 2.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.84 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.1 mt -58.58 -40.71 83.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -54.18 -40.62 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.646 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.8 mm100 -60.05 -52.96 63.15 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.475 ' HA ' ' CD1' ' A' ' 27' ' ' ILE . 10.4 mt -44.31 -22.4 0.07 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.208 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.444 ' N ' ' C ' ' A' ' 23' ' ' GLN . 19.3 ttm-85 -86.95 -27.2 23.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.257 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 23' ' ' GLN . 26.4 mt-10 -88.49 -55.75 3.59 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.414 1.265 . . . . 0.0 114.414 -177.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.475 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.52 -60.02 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.615 -176.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER -84.82 -4.52 59.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.693 -178.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.27 32.49 67.9 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.834 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.443 HG22 HD12 ' A' ' 30' ' ' ILE . 3.5 mt -98.96 145.47 10.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.77 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 33' ' ' THR . 15.0 m-20 -97.33 -44.46 6.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.51 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.82 88.45 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.554 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.575 ' N ' ' O ' ' A' ' 31' ' ' ASN . 19.1 p -60.92 -23.88 65.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.45 -44.75 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.05 0.453 . . . . 0.0 110.237 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.4 mt -73.87 -31.2 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.498 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.7 mt -70.59 -63.57 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.808 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.532 ' OE1' ' N ' ' A' ' 38' ' ' GLN . 0.0 OUTLIER -47.39 -35.48 8.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.103 0.478 . . . . 0.0 110.369 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 37' ' ' GLN . 3.5 tp60 -73.34 -34.15 65.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.959 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 43' ' ' SER . . . -62.64 -44.56 95.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.683 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.486 ' CD1' ' CD1' ' A' ' 20' ' ' PHE . 3.2 tt -62.89 -44.46 96.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.952 0.406 . . . . 0.0 110.579 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' CB ' ' HZ1' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -56.69 -33.55 66.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.657 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 m-20 -87.18 -23.35 24.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.888 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 0.3 OUTLIER -88.96 -7.91 55.13 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.026 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.401 ' N ' HD21 ' A' ' 44' ' ' ASN . 3.0 m120 66.27 21.84 10.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.313 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.47 14.54 27.56 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.731 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.535 ' OD1' ' O ' ' A' ' 43' ' ' SER . 4.8 m120 -107.95 127.39 53.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.469 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -68.78 -62.81 1.23 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.4 ' O ' ' CB ' ' A' ' 52' ' ' ALA . 50.5 mt-10 -44.54 -21.69 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.012 0.434 . . . . 0.0 110.702 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.716 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -90.22 -39.44 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.684 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.525 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -64.45 -50.89 65.74 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.6 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 7.6 p -59.63 -49.43 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.368 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.744 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -61.53 -33.94 74.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.528 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -59.11 -28.35 66.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.287 179.312 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.7 mp -80.53 -55.11 5.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.436 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.546 ' O ' ' N ' ' A' ' 57' ' ' LYS . 3.1 t -87.76 -44.8 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.008 0.433 . . . . 0.0 110.126 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.744 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 26.68 -90.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.8 179.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.546 ' N ' ' O ' ' A' ' 55' ' ' THR . 10.1 tptp 69.41 -61.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.308 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 56' ' ' ALA . 70.0 m-80 -126.54 -22.08 4.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.063 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -90.27 83.39 5.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.655 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.64 ' O ' ' CB ' ' A' ' 61' ' ' THR . 15.8 tttt -81.43 -99.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.196 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.64 ' CB ' ' O ' ' A' ' 60' ' ' LYS . 1.3 m 93.65 76.52 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.251 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.559 ' C ' ' H ' ' A' ' 64' ' ' GLN . 53.7 Cg_endo -91.07 -126.7 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 123.375 2.716 . . . . 0.0 111.835 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.433 ' N ' ' OE2' ' A' ' 65' ' ' GLU . 1.6 tt0 70.1 -16.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.797 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.559 ' H ' ' C ' ' A' ' 62' ' ' PRO . 1.8 tp60 -139.99 59.61 1.57 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.792 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.624 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -99.29 122.48 42.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.267 179.797 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.79 -176.13 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.489 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.412 HG23 ' N ' ' A' ' 68' ' ' THR . 3.3 m -108.6 144.7 35.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.68 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.412 ' N ' HG23 ' A' ' 67' ' ' THR . 0.2 OUTLIER -44.31 -53.7 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.444 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 58.9 t80 62.35 143.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.68 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.67 -159.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.281 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -109.15 -26.43 10.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.577 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.568 ' O ' ' CB ' ' A' ' 73' ' ' ALA . 2.3 p -51.14 163.34 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.568 ' CB ' ' O ' ' A' ' 72' ' ' THR . . . 156.65 23.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.305 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' C ' ' O ' ' A' ' 73' ' ' ALA . 2.9 tp -27.24 93.93 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.499 ' N ' ' O ' ' A' ' 73' ' ' ALA . 50.4 Cg_exo -49.24 -18.75 2.25 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.686 2.257 . . . . 0.0 112.161 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.17 -153.38 37.56 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.525 ' OD1' ' C ' ' A' ' 77' ' ' ASN . 19.5 t-20 -173.6 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.87 0.367 . . . . 0.0 110.596 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -77.22 -174.7 3.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.567 ' C ' ' H ' ' A' ' 81' ' ' ILE . 6.2 mmm180 -84.89 -24.67 28.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.338 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER 70.27 -35.08 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.516 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.626 ' C ' ' H ' ' A' ' 83' ' ' VAL . 0.4 OUTLIER -128.77 143.21 41.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.349 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.465 ' O ' ' C ' ' A' ' 83' ' ' VAL . 1.4 m -67.03 19.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.626 ' H ' ' C ' ' A' ' 81' ' ' ILE . 11.8 m 32.73 38.53 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 82' ' ' SER . . . 68.81 87.34 0.09 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.13 23.9 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.238 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -57.57 -27.42 62.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.875 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 70.31 170.4 0.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -118.73 -54.35 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.681 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.84 140.9 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.61 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.612 ' O ' ' ND2' ' A' ' 90' ' ' ASN . 0.7 OUTLIER 179.83 29.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.281 0.563 . . . . 0.0 109.742 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.3 m -98.23 164.84 2.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.214 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.563 ' CG1' ' H ' ' A' ' 93' ' ' ASP . 0.3 OUTLIER 179.28 -161.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.932 178.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.563 ' H ' ' CG1' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -145.32 128.81 16.99 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.219 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.455 HD11 ' H ' ' A' ' 94' ' ' LEU . 0.3 OUTLIER -128.3 12.15 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.827 -179.797 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.452 ' O ' ' C ' ' A' ' 96' ' ' GLY . 2.7 t -129.32 -15.65 4.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.452 ' C ' ' O ' ' A' ' 95' ' ' THR . . . -34.68 -67.9 0.25 Allowed Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.597 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -67.3 90.93 0.23 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.821 0.343 . . . . 0.0 110.433 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -53.98 147.32 12.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.711 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.44 ' HG3' ' HZ2' ' A' ' 99' ' ' LYS . 3.1 mttp -91.62 -6.24 52.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.649 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -87.62 -31.26 19.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.765 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -48.97 -27.42 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.9 OUTLIER -77.19 -52.98 8.31 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.045 0.45 . . . . 0.0 110.669 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.435 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.3 mp0 -44.25 -18.82 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -85.97 -39.11 17.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.451 -1.249 . . . . 0.0 109.99 179.548 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -50.33 -57.39 8.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.521 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.435 ' CD1' ' HA ' ' A' ' 103' ' ' GLN . 0.1 OUTLIER -65.31 -54.68 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-O 121.566 0.698 . . . . 0.0 110.332 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.51 -60.23 1.83 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.51 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -47.87 -40.11 20.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.497 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.1 OUTLIER -68.56 -45.33 72.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.473 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mp -48.46 -19.05 0.28 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.497 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.21 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.226 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -49.39 -19.61 0.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.016 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.605 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.3 OUTLIER -89.85 -52.35 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 179.614 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -47.56 -10.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.784 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.605 ' H ' ' C ' ' A' ' 113' ' ' SER . 10.2 mpt_? -106.15 -36.61 6.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.827 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.576 ' O ' ' O ' ' A' ' 117' ' ' PHE . . . -88.73 -7.44 56.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.122 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.576 ' O ' ' O ' ' A' ' 116' ' ' ALA . 50.6 t80 -43.16 178.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.715 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.552 ' N ' ' CG ' ' A' ' 117' ' ' PHE . 4.8 mtt180 -89.33 82.26 6.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.275 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.516 ' CD ' ' O ' ' A' ' 119' ' ' GLU . 0.5 OUTLIER -70.56 48.13 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.102 -179.481 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.5 t -53.69 171.49 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.001 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -171.99 -79.64 0.05 OUTLIER Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.642 ' C ' ' HG1' ' A' ' 123' ' ' THR . 0.1 OUTLIER -150.89 143.62 16.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.92 0.391 . . . . 0.0 110.83 -179.567 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.642 ' HG1' ' C ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -168.15 26.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.165 179.836 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 124' ' ' ASP . 0.6 OUTLIER -118.04 45.26 2.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.729 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -79.06 -35.22 42.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -53.53 45.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.453 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.447 ' HG3' ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -64.51 -35.98 82.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.161 179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.473 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -59.22 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.175 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.473 ' C ' ' O ' ' A' ' 128' ' ' ALA . 9.1 mm -35.76 -40.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.318 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 30.8 t -66.49 -69.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.497 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -42.15 -48.68 4.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.653 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 13.7 t -57.22 -62.39 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.673 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.38 -35.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.461 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -61.97 -49.05 77.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.535 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.07 -17.4 25.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.738 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.6 m -87.39 -50.41 6.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.499 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 8.6 tt -76.0 -13.24 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.488 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -96.25 4.15 52.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.697 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -96.3 103.1 14.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.449 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -144.84 63.86 1.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.87 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.56 117.02 18.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.23 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -112.58 -153.73 0.53 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.449 ' O ' ' SG ' ' A' ' 143' ' ' CYS . 47.2 t -157.83 32.82 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.384 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.566 ' CD2' ' C ' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -60.73 155.67 18.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.557 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER -150.6 13.11 0.73 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.285 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.625 HH11 ' CG ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.582 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ttt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.563 ' O ' ' N ' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -110.34 89.75 3.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.443 ' C ' ' O ' ' A' ' 2' ' ' THR . 9.4 p 35.63 28.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.838 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 2' ' ' THR . 2.9 mt-10 -119.18 -165.35 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.38 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 4' ' ' GLU . 0.0 OUTLIER 37.77 31.48 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.56 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.595 ' C ' ' H ' ' A' ' 8' ' ' LEU . 6.2 m-20 61.81 -88.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.456 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.5 t 52.09 6.01 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.449 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.595 ' H ' ' C ' ' A' ' 6' ' ' ASN . 0.9 OUTLIER -87.85 -0.57 57.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.656 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.464 ' N ' HD23 ' A' ' 8' ' ' LEU . 19.0 tt0 -83.37 50.46 1.77 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.71 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -121.98 166.03 15.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.328 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.45 -44.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.12 -16.46 61.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -70.57 -21.41 62.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.623 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.84 69.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.733 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.43 ' H ' ' HG2' ' A' ' 15' ' ' LYS . 62.1 mmtt -70.21 -19.15 63.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.609 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -82.11 -19.51 39.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.947 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.458 ' OE1' ' CD1' ' A' ' 21' ' ' LEU . 0.9 OUTLIER -45.7 -40.16 8.94 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.913 0.387 . . . . 0.0 110.18 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -43.74 -58.33 2.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.48 -34.43 67.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.451 0.643 . . . . 0.0 110.648 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.479 ' CZ ' HD11 ' A' ' 40' ' ' LEU . 1.1 t80 -50.72 -60.61 2.87 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.273 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.458 ' CD1' ' OE1' ' A' ' 17' ' ' GLN . 2.0 mt -66.24 -47.19 74.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.117 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -48.71 -42.75 36.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.144 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.571 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.7 OUTLIER -63.16 -53.64 50.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.001 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.524 ' O ' ' CG2' ' A' ' 28' ' ' THR . 26.4 mt -47.91 -26.1 1.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.4 ttm105 -85.38 -19.14 31.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.447 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 23' ' ' GLN . 7.0 tt0 -86.6 -58.53 2.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.597 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -67.24 -54.8 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.548 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.597 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.3 t -87.75 -2.57 58.7 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.588 -176.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 60.83 4.66 4.48 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.622 -0.717 . . . . 0.0 113.67 177.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.474 HG21 ' H ' ' A' ' 32' ' ' ASP . 40.8 mm -65.99 125.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 118.077 0.939 . . . . 0.0 109.961 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.479 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -105.57 30.78 5.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.234 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.474 ' H ' HG21 ' A' ' 30' ' ' ILE . 14.9 m-20 -100.7 88.85 3.71 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.4 m -53.84 -30.41 45.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.895 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -67.7 -51.89 44.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.498 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.81 -22.25 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.413 ' O ' ' N ' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -73.71 -63.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.584 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -51.8 -27.53 12.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -73.82 -25.27 60.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.456 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.481 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -73.97 -35.37 64.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.006 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.479 HD11 ' CZ ' ' A' ' 20' ' ' PHE . 14.1 tp -67.36 -47.75 69.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.399 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -59.78 -41.78 91.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.359 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.469 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -86.34 -15.65 39.85 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.116 -179.391 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.591 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 1.7 t -76.8 -31.21 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.483 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.662 ' OD1' ' ND2' ' A' ' 46' ' ' ASN . 0.5 OUTLIER 84.51 13.51 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.931 -179.529 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.21 13.37 31.26 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.112 -0.565 . . . . 0.0 112.388 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.662 ' ND2' ' OD1' ' A' ' 44' ' ' ASN . 51.0 m-20 -107.92 130.67 55.01 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' A' ' 50' ' ' ALA . 53.7 tp -86.02 -64.76 1.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -177.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -46.44 -26.33 0.83 Allowed 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.678 0.751 . . . . 0.0 109.276 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.573 ' CD2' ' C ' ' A' ' 49' ' ' LEU . 0.1 OUTLIER -87.19 -29.85 21.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.387 179.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.696 ' O ' ' N ' ' A' ' 53' ' ' PHE . . . -74.26 -58.37 3.34 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.478 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 14.5 p -43.63 -40.07 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.768 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -67.64 -27.89 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.252 -1.34 . . . . 0.0 110.392 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.696 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -60.0 -28.92 68.1 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.452 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 5.6 mp -80.62 -53.51 6.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.299 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.61 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -86.8 -47.79 8.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.025 179.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.768 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 30.58 104.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.092 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.664 ' O ' ' N ' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -69.36 -174.1 0.63 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.172 -179.71 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.789 HD22 ' H ' ' A' ' 63' ' ' GLN . 4.6 t30 38.81 16.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.075 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.664 ' N ' ' O ' ' A' ' 57' ' ' LYS . . . 60.77 -73.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.333 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.577 ' N ' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -117.21 -72.47 0.69 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.144 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.561 ' N ' ' CD ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -175.7 -47.07 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 C-N-CA 120.801 -0.359 . . . . 0.0 111.11 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 61' ' ' THR . 50.0 Cg_endo -87.93 32.67 0.41 Allowed 'Trans proline' 0 C--N 1.304 -1.805 0 C-N-CA 123.186 2.591 . . . . 0.0 112.205 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.789 ' H ' HD22 ' A' ' 58' ' ' ASN . 3.9 tt0 -102.03 -156.28 0.55 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.279 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.462 ' H ' ' HG2' ' A' ' 63' ' ' GLN . 3.8 mp0 -67.08 60.02 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.444 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.558 ' O ' ' OD1' ' A' ' 58' ' ' ASN . 4.7 mt-10 36.95 -130.3 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.544 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -132.68 23.25 4.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.466 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.466 ' CG2' ' H ' ' A' ' 68' ' ' THR . 4.4 m 70.97 -128.41 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.645 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.466 ' H ' ' CG2' ' A' ' 67' ' ' THR . 27.8 p -141.16 -52.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.709 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.455 ' CD2' ' O ' ' A' ' 68' ' ' THR . 15.8 m-85 -163.75 160.86 23.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.704 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.664 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -116.61 -165.03 1.02 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -122.63 104.04 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.555 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 79.8 p -123.67 -26.07 4.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.53 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.475 ' O ' ' C ' ' A' ' 74' ' ' LEU . . . -91.26 -151.46 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.537 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' A' ' 73' ' ' ALA . 3.2 tp 34.03 91.95 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.568 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -81.47 -3.84 12.12 Favored 'Trans proline' 0 C--N 1.306 -1.658 0 C-N-CA 122.795 2.33 . . . . 0.0 111.985 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.6 -0.24 42.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.514 ' O ' ' ND2' ' A' ' 77' ' ' ASN . 0.8 OUTLIER 47.8 53.1 11.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.799 0.333 . . . . 0.0 110.57 179.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.77 169.27 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.462 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.476 ' CG ' ' N ' ' A' ' 80' ' ' TYR . 45.0 ttp180 -155.01 160.35 41.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.591 ' O ' ' C ' ' A' ' 81' ' ' ILE . 0.2 OUTLIER -116.04 -171.86 2.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.429 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.591 ' C ' ' O ' ' A' ' 80' ' ' TYR . 0.2 OUTLIER 16.04 76.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.198 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.7 p -98.42 -31.87 11.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.549 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 15.4 t -83.04 66.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.684 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.506 ' O ' ' C ' ' A' ' 85' ' ' SER . . . -60.32 -44.94 97.0 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.756 -0.937 . . . . 0.0 110.756 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 84' ' ' GLY . 4.8 p 30.66 50.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.786 0.327 . . . . 0.0 110.674 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -76.12 -171.09 1.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.466 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.39 131.56 52.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.553 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -131.82 33.83 3.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.559 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.2 t -135.63 125.53 25.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.409 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.534 ' O ' ' CG ' ' A' ' 90' ' ' ASN . 15.7 t30 -169.67 25.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.298 0.571 . . . . 0.0 109.691 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.48 153.88 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.037 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.567 ' CG1' ' H ' ' A' ' 93' ' ' ASP . 0.8 OUTLIER -179.8 -159.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.634 178.945 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.567 ' H ' ' CG1' ' A' ' 92' ' ' ILE . 1.2 p30 -116.34 136.31 53.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.501 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -94.62 -5.96 44.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.64 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.432 HG21 ' H ' ' A' ' 96' ' ' GLY . 0.1 OUTLIER -116.37 -57.48 2.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.679 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.432 ' H ' HG21 ' A' ' 95' ' ' THR . . . 102.69 11.61 34.78 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -179.56 145.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.841 0.353 . . . . 0.0 110.425 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -69.13 154.81 41.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.466 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' C ' ' N ' ' A' ' 101' ' ' ASP . 7.2 mmmt -86.29 -5.93 59.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.613 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.502 ' OD1' ' N ' ' A' ' 101' ' ' ASP . 60.1 p30 -49.33 -17.64 0.28 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.502 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 12.3 m-20 -55.31 -23.5 23.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.605 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.611 ' CD1' ' N ' ' A' ' 103' ' ' GLN . 4.2 pp -56.03 -46.11 78.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.086 0.469 . . . . 0.0 110.16 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.611 ' N ' ' CD1' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.14 -19.71 0.08 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.528 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.534 ' N ' ' C ' ' A' ' 102' ' ' LEU . 20.8 ttp85 -85.09 -37.04 20.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.968 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -62.95 -45.3 93.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.314 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.558 ' CD1' ' N ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -69.44 -32.66 53.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-O 121.236 0.541 . . . . 0.0 110.537 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.36 -60.29 3.58 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.237 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 30.7 mt -47.24 -42.58 20.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.521 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.454 ' C ' ' N ' ' A' ' 111' ' ' ALA . 81.2 p -72.69 -41.77 64.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.661 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 mt -48.2 -19.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.454 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -89.44 -58.59 2.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.24 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -48.21 -21.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.563 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.659 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.2 OUTLIER -89.65 -46.85 8.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.879 179.289 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.661 ' O ' ' ND2' ' A' ' 114' ' ' ASN . 0.2 OUTLIER -39.01 -20.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.218 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.659 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -107.21 -40.39 5.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.199 179.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.438 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -95.61 23.09 6.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.504 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.536 ' N ' ' O ' ' A' ' 113' ' ' SER . 12.8 t80 -83.34 -78.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.659 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -49.66 -37.13 27.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.587 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 59.88 42.91 15.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.52 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.536 ' HG1' ' H ' ' A' ' 121' ' ' GLY . 2.2 t -88.18 172.72 9.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.622 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . 0.536 ' H ' ' HG1' ' A' ' 120' ' ' THR . . . 83.52 16.67 68.04 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 8.3 tp -59.3 148.13 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.75 0.31 . . . . 0.0 110.496 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 65.6 p -126.26 106.62 9.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -84.11 125.02 31.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.484 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -48.7 -54.69 13.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.869 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -51.24 -48.74 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.7 -25.89 67.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.774 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.45 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.75 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.6 mp -49.35 -33.07 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.845 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' CB ' ' A' ' 134' ' ' GLU . 0.0 OUTLIER -68.73 -25.3 64.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.747 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 4.5 mmm180 -85.26 -49.59 8.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -54.98 -40.99 56.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.503 ' N ' ' CG1' ' A' ' 132' ' ' VAL . 4.1 tp -80.55 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.544 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 130' ' ' SER . 1.4 tt0 -38.0 -31.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.362 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . -78.62 -52.5 8.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.57 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -40.78 25.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.26 -62.22 2.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.597 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . 59.82 162.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.47 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -119.81 64.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.627 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.414 ' OD1' ' N ' ' A' ' 140' ' ' ASN . 1.6 m120 -92.25 -10.67 37.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.429 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.629 ' NZ ' ' SG ' ' A' ' 143' ' ' CYS . 19.9 tttm -94.47 126.29 39.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.726 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -123.76 104.67 9.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.485 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.629 ' SG ' ' NZ ' ' A' ' 141' ' ' LYS . 58.2 m -62.67 151.29 38.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.648 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.427 ' CD2' ' N ' ' A' ' 144' ' ' LEU . 4.5 mm? -84.96 91.99 8.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.566 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -40.3 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.505 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.416 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.563 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.569 ' O ' ' N ' ' A' ' 4' ' ' GLU . 4.2 m -92.61 -73.3 0.56 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.436 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 p -57.1 75.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.734 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 2' ' ' THR . 1.6 mt-10 -129.2 148.55 51.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.74 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.545 ' O ' ' C ' ' A' ' 6' ' ' ASN . 2.5 tt0 -151.83 -55.44 0.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.355 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.545 ' C ' ' O ' ' A' ' 5' ' ' GLN . 14.2 p-10 26.96 56.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.801 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -43.94 135.02 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.298 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 57.7 tp -161.34 135.28 6.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.669 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -93.6 108.94 20.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.109 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.584 ' O ' ' CB ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -124.81 -171.83 2.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.765 -179.667 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.584 ' CB ' ' O ' ' A' ' 10' ' ' GLN . 1.8 t 88.62 -147.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.725 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.5 -15.6 63.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.57 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.39 -20.88 66.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.766 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -50.72 -19.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.919 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 -18.78 33.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.371 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -50.63 -33.34 21.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.295 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.796 ' NE2' ' H ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -45.65 -29.67 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.728 -179.646 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.65 ' N ' ' OE1' ' A' ' 18' ' ' GLN . 3.8 mp0 -61.52 -58.28 8.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.663 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -73.78 -34.92 64.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.446 0.641 . . . . 0.0 110.213 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.479 ' CE1' HD23 ' A' ' 40' ' ' LEU . 2.1 t80 -51.89 -60.77 2.79 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.91 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.9 mt -67.72 -31.99 72.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.983 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.455 ' HB3' HE22 ' A' ' 23' ' ' GLN . 1.6 t30 -60.11 -41.87 93.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 0.0 110.147 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.747 ' NE2' ' N ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -67.32 -50.18 61.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.109 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.492 ' O ' ' CG2' ' A' ' 28' ' ' THR . 12.6 mt -45.57 -31.82 2.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.33 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.1 ttt-85 -87.61 -20.62 26.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.908 0.385 . . . . 0.0 110.492 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.541 ' OE2' ' O ' ' A' ' 65' ' ' GLU . 2.1 tt0 -87.58 -58.08 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.473 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -62.76 -44.59 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.196 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.492 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 1.4 t -99.64 -2.68 34.89 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.676 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 63.65 19.33 62.62 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.453 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 mm -79.12 113.56 18.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.541 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -76.75 -50.77 12.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.788 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.7 m-20 -41.43 103.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.308 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.6 t -71.76 -27.22 62.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.737 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -59.64 -41.71 91.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.518 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.504 HG21 HD13 ' A' ' 35' ' ' ILE . 12.8 mm -68.38 -45.84 81.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.705 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.645 ' O ' ' N ' ' A' ' 39' ' ' ALA . 18.2 mt -63.98 -60.75 2.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.189 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 36' ' ' LEU . 4.9 mm-40 -43.46 -29.2 0.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.421 ' N ' ' C ' ' A' ' 36' ' ' LEU . 3.1 tt0 -78.87 -32.28 45.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.083 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.645 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -69.64 -33.79 73.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.514 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 3.0 tm? -66.12 -38.28 87.79 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.093 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -71.13 -42.61 68.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.97 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.56 -24.13 25.57 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.861 0.363 . . . . 0.0 111.481 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.593 ' OG ' ' O ' ' A' ' 39' ' ' ALA . 6.9 p -62.82 -30.3 71.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.778 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.2 t-20 83.66 14.28 0.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.01 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.84 4.97 48.24 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.06 -0.59 . . . . 0.0 111.642 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.403 ' O ' HD21 ' A' ' 49' ' ' LEU . 2.9 m120 -100.74 130.16 46.74 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.655 ' O ' ' N ' ' A' ' 50' ' ' ALA . 2.1 tt -85.75 -62.84 1.43 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.879 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.518 ' O ' ' CG1' ' A' ' 51' ' ' VAL . 3.5 mt-10 -41.4 -38.21 1.19 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.093 0.473 . . . . 0.0 110.393 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.492 ' CD2' ' C ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -81.13 -26.56 36.04 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.235 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.655 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -69.63 -58.46 3.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.518 ' CG1' ' O ' ' A' ' 48' ' ' GLU . 1.6 p -44.41 -44.96 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.74 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 177.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.722 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -61.73 -28.62 69.55 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.282 -1.781 . . . . 0.0 110.361 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.641 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -64.32 -29.51 70.59 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.509 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.478 ' CD2' ' N ' ' A' ' 54' ' ' LEU . 3.1 mm? -75.66 -57.59 3.79 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.287 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.609 ' O ' ' CD ' ' A' ' 57' ' ' LYS . 3.1 t -89.84 -44.86 9.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.683 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.722 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 42.9 47.52 4.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.564 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.727 ' HZ3' ' CB ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -169.92 -56.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.349 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.433 ' H ' ' CG ' ' A' ' 57' ' ' LYS . 15.7 t-20 -178.9 120.72 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.634 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 176.53 121.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.452 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.533 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.0 OUTLIER -141.0 -171.3 3.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.375 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.533 ' OG1' ' O ' ' A' ' 60' ' ' LYS . 1.3 m 169.71 91.86 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.166 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.563 ' O ' ' N ' ' A' ' 64' ' ' GLN . 93.4 Cg_endo -90.63 -16.14 1.64 Allowed 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.156 2.571 . . . . 0.0 112.119 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.59 ' O ' ' C ' ' A' ' 64' ' ' GLN . 7.0 tt0 -29.91 92.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.269 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.59 ' C ' ' O ' ' A' ' 63' ' ' GLN . 5.1 mm-40 -15.18 89.41 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.464 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.541 ' O ' ' OE2' ' A' ' 26' ' ' GLU . 18.8 tt0 -130.76 120.8 24.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.564 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -163.24 -64.93 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.397 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.4 t -177.49 -16.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.723 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.58 ' CG2' ' H ' ' A' ' 69' ' ' TYR . 7.5 m 66.8 -131.26 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.656 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.58 ' H ' ' CG2' ' A' ' 68' ' ' THR . 58.5 m-85 57.3 170.97 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.672 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -78.98 -150.74 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.61 ' C ' ' H ' ' A' ' 73' ' ' ALA . 2.0 tm0? -109.79 -63.0 1.42 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.484 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.477 ' O ' ' O ' ' A' ' 73' ' ' ALA . 88.9 m 60.12 -7.53 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.08 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.61 ' H ' ' C ' ' A' ' 71' ' ' GLN . . . 36.26 -157.63 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.546 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.3 tp -52.86 112.65 3.7 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.669 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -46.96 -28.06 6.66 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.295 1.997 . . . . 0.0 112.036 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.542 ' O ' ' C ' ' A' ' 77' ' ' ASN . . . 61.81 -170.33 10.79 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.542 ' C ' ' O ' ' A' ' 76' ' ' GLY . 7.6 p30 28.7 67.92 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.764 0.316 . . . . 0.0 110.512 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.471 ' CG ' ' O ' ' A' ' 78' ' ' ASP . 7.2 p-10 -160.92 103.5 1.31 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.882 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.443 ' HE ' ' HB ' ' A' ' 83' ' ' VAL . 19.5 ttp180 -124.54 15.09 8.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.232 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 64.66 -51.82 0.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.524 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.427 HD11 HG21 ' A' ' 81' ' ' ILE . 10.4 mt -105.09 171.89 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.907 0.384 . . . . 0.0 111.044 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.419 ' H ' HG23 ' A' ' 81' ' ' ILE . 2.5 m -41.83 138.43 1.48 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.627 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.443 ' HB ' ' HE ' ' A' ' 79' ' ' ARG . 8.4 p -158.38 63.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.575 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.01 -50.45 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 59.95 76.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.696 0.284 . . . . 0.0 110.647 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -79.81 -92.14 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.57 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -170.43 -175.27 1.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.465 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 89' ' ' THR . 3.6 t0 -150.2 -36.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.457 ' O ' ' O ' ' A' ' 88' ' ' ASP . 23.9 m 57.56 116.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.196 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -174.08 32.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.13 0.49 . . . . 0.0 109.828 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.5 161.18 3.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.134 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.577 ' CG2' ' N ' ' A' ' 93' ' ' ASP . 1.9 tt -179.79 -160.58 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.816 179.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.577 ' N ' ' CG2' ' A' ' 92' ' ' ILE . 68.9 m-20 -54.47 -43.43 71.72 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.687 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.522 ' CB ' ' O ' ' A' ' 93' ' ' ASP . 0.6 OUTLIER 81.79 -53.81 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.383 -179.858 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.495 ' O ' ' C ' ' A' ' 96' ' ' GLY . 3.1 t -74.75 -36.04 62.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.215 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.495 ' C ' ' O ' ' A' ' 95' ' ' THR . . . 31.08 47.28 0.17 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -87.96 150.51 23.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.69 0.281 . . . . 0.0 110.381 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -106.06 86.18 2.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -79.65 -47.51 15.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.178 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -37.12 39.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.973 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -80.33 -21.87 42.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.262 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.642 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.8 OUTLIER -64.86 -52.92 54.02 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.064 0.459 . . . . 0.0 110.325 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.406 ' C ' ' O ' ' A' ' 102' ' ' LEU . 3.9 mm-40 -44.67 -18.33 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.583 ' N ' ' C ' ' A' ' 102' ' ' LEU . 13.5 tpp180 -84.54 -35.5 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.873 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.642 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.91 -40.71 94.19 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.406 HG21 HD11 ' A' ' 106' ' ' ILE . 1.3 mm -67.75 -40.32 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.611 0.72 . . . . 0.0 109.772 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.91 75.28 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.214 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.84 -41.05 86.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.133 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.458 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.3 m -72.91 -47.89 41.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.225 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.43 -18.58 0.24 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.458 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -84.99 -52.86 5.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.274 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -47.12 -20.96 0.19 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.519 . . . . 0.0 109.74 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.616 ' C ' ' H ' ' A' ' 115' ' ' ARG . 20.1 m -87.42 -54.03 4.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.039 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -48.35 -11.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.616 ' H ' ' C ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -94.82 -42.23 8.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.055 178.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -83.68 20.24 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.529 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.49 171.24 19.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.427 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.65 ' C ' ' H ' ' A' ' 120' ' ' THR . 9.8 ptt85 175.1 -50.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.949 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 45.97 6.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.018 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.65 ' H ' ' C ' ' A' ' 118' ' ' ARG . 45.1 p -48.1 -53.0 18.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.404 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 78.95 93.25 0.32 Allowed Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.428 HD12 HG23 ' A' ' 122' ' ' ILE . 6.3 mt -147.93 127.27 4.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.475 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.0 156.25 39.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.447 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -109.38 -38.25 5.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.477 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE2' ' OE1' ' A' ' 126' ' ' GLU . 1.0 OUTLIER -49.95 -32.72 15.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.474 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.568 ' OE1' ' OE2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -60.89 -31.59 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.988 0.423 . . . . 0.0 110.177 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.43 -37.41 65.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.458 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.06 -65.8 0.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.2 pt -46.68 -32.84 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.411 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -63.02 -37.98 89.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.638 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -65.76 -39.38 91.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.8 t -57.73 -57.69 9.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.635 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.0 mp -48.77 -59.45 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.691 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -52.53 -58.48 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -51.23 -32.49 24.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.85 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 5.7 p -92.26 -5.23 52.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.86 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -113.45 -72.76 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.462 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.598 ' O ' ' O ' ' A' ' 139' ' ' GLU . . . 59.77 98.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.713 ' CG ' ' H ' ' A' ' 140' ' ' ASN . 1.1 tp10 13.44 -134.47 0.0 OUTLIER 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.746 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.713 ' H ' ' CG ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER 160.29 -169.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.633 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.686 ' CB ' ' HZ3' ' A' ' 141' ' ' LYS . 0.0 OUTLIER 33.59 66.7 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.783 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.657 ' O ' ' SG ' ' A' ' 143' ' ' CYS . . . -50.31 -23.77 2.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.527 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.657 ' SG ' ' O ' ' A' ' 142' ' ' ALA . 1.3 m 155.89 -172.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.614 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.552 ' CD2' ' N ' ' A' ' 144' ' ' LEU . 1.8 pt? -165.57 42.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -109.07 115.08 29.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.565 ' OXT' ' CG ' ' A' ' 146' ' ' ARG . 21.2 ptt180 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.463 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.623 ' C ' ' H ' ' A' ' 4' ' ' GLU . 2.2 t -154.01 79.85 1.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.562 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.3 p -48.23 -6.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.811 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.623 ' H ' ' C ' ' A' ' 2' ' ' THR . 20.7 tt0 176.3 130.98 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.653 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.455 ' HG2' ' H ' ' A' ' 6' ' ' ASN . 4.4 tt0 -118.6 -157.34 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.373 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.455 ' H ' ' HG2' ' A' ' 5' ' ' GLN . 3.0 m120 62.98 -127.36 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.22 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.598 ' O ' ' O ' ' A' ' 8' ' ' LEU . 11.1 m -156.06 -46.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.496 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.598 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.2 OUTLIER 23.76 103.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.034 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.86 59.8 3.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.699 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.606 ' O ' ' N ' ' A' ' 12' ' ' ALA . 3.3 pt20 -74.95 135.77 41.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.511 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.7 t -60.11 68.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.624 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.606 ' N ' ' O ' ' A' ' 10' ' ' GLN . . . -53.71 -17.65 2.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.636 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.525 ' O ' ' OE1' ' A' ' 17' ' ' GLN . . . -73.42 -30.33 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.626 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.443 ' HA ' ' NE2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -57.62 -26.91 62.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.463 ' NZ ' ' O ' ' A' ' 15' ' ' LYS . 3.4 tmtm? -85.44 -18.62 33.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.667 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -22.18 38.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.516 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -50.72 -25.86 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.717 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -58.61 7.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.794 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.46 HG23 ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -73.75 -41.26 62.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.334 0.588 . . . . 0.0 110.381 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.479 ' CE1' HD22 ' A' ' 40' ' ' LEU . 19.4 t80 -50.53 -61.02 2.44 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.142 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.8 mt -59.25 -49.93 75.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.145 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -44.74 -41.21 6.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.665 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -65.17 -52.48 54.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.866 179.025 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.47 ' HA ' ' CD1' ' A' ' 27' ' ' ILE . 11.2 mt -43.66 -28.07 0.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.824 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.36 -23.12 24.68 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.131 0.491 . . . . 0.0 109.742 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.665 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -88.02 -56.69 3.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.016 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.47 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.14 -59.53 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 121.016 0.436 . . . . 0.0 111.741 -176.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.599 ' OG1' ' CD1' ' A' ' 30' ' ' ILE . 0.2 OUTLIER -81.35 -13.53 58.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.24 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.36 31.97 82.12 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.599 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 0.4 OUTLIER -90.07 152.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.913 0.387 . . . . 0.0 110.532 -179.065 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -105.15 -39.38 6.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.746 -179.663 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -48.75 85.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.21 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.587 ' N ' ' O ' ' A' ' 31' ' ' ASN . 18.0 p -60.8 -20.21 61.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.012 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -66.99 -49.61 64.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 110.971 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.82 -31.23 52.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.137 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.8 mt -63.59 -61.78 2.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.758 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.452 ' CG ' ' O ' ' A' ' 33' ' ' THR . 0.0 OUTLIER -48.7 -27.24 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.245 0.545 . . . . 0.0 109.59 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.491 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 5.1 mt-30 -80.4 -37.95 31.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.372 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.76 97.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.114 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.615 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.3 OUTLIER -62.54 -42.29 99.43 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.472 ' N ' HD13 ' A' ' 40' ' ' LEU . 1.9 mmtp -52.22 -33.39 41.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.908 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.506 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.5 OUTLIER -86.74 -43.87 12.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.599 179.559 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.746 ' HG ' ' H ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -65.63 -29.54 70.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.466 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 43' ' ' SER . 4.4 p30 48.65 53.16 12.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.056 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.38 -9.42 57.49 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.547 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.746 ' H ' ' HG ' ' A' ' 43' ' ' SER . 4.9 m120 -96.0 116.39 28.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.007 0.404 . . . . 0.0 110.198 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -77.41 -63.82 1.29 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.476 -178.492 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.427 ' C ' ' O ' ' A' ' 47' ' ' LEU . 24.9 tt0 -42.88 -20.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.706 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.6 mm? -87.69 -52.48 5.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.713 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.514 ' O ' ' CD1' ' A' ' 54' ' ' LEU . . . -51.1 -47.15 62.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.733 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 6.5 p -63.21 -62.66 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 CA-C-O 121.517 0.675 . . . . 0.0 109.219 178.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.733 ' H ' ' CG1' ' A' ' 51' ' ' VAL . . . -47.36 -27.42 1.62 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.236 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -65.74 -38.02 88.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.081 178.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.514 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.8 mp -69.8 -56.65 6.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.261 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.594 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -80.85 -50.37 9.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.052 179.638 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.691 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 27.21 103.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.166 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -86.62 105.51 16.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.55 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.473 ' O ' ' C ' ' A' ' 59' ' ' ALA . 2.3 t-20 69.25 -60.18 0.47 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.404 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.473 ' C ' ' O ' ' A' ' 58' ' ' ASN . . . -34.22 139.25 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.611 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.526 ' C ' ' HG1' ' A' ' 61' ' ' THR . 11.9 tttm -162.15 137.31 7.17 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.736 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.526 ' HG1' ' C ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER 173.84 70.64 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.218 0 CA-C-O 121.045 0.45 . . . . 0.0 110.658 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.412 ' HD3' ' HZ1' ' A' ' 60' ' ' LYS . 73.9 Cg_endo -92.17 -98.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 123.406 2.737 . . . . 0.0 112.389 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.68 ' O ' ' N ' ' A' ' 65' ' ' GLU . 19.2 tm0? 72.0 145.85 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.2 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -56.14 69.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.473 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.68 ' N ' ' O ' ' A' ' 63' ' ' GLN . 3.6 tt0 -73.43 133.68 43.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 65' ' ' GLU . 2.8 mp0 -59.61 -152.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.463 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.609 ' OG1' ' N ' ' A' ' 68' ' ' THR . 0.2 OUTLIER -124.91 -93.12 0.5 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.692 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.609 ' N ' ' OG1' ' A' ' 67' ' ' THR . 25.5 m 65.19 104.58 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.302 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.633 ' N ' ' CD1' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -104.21 -177.73 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.751 -179.72 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.469 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -82.1 -169.31 2.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.602 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -102.4 -178.86 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.703 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.657 ' OG1' ' N ' ' A' ' 73' ' ' ALA . 0.2 OUTLIER -112.86 -165.97 1.04 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.425 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.657 ' N ' ' OG1' ' A' ' 72' ' ' THR . . . 162.06 137.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.415 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.652 ' CD2' ' O ' ' A' ' 74' ' ' LEU . 0.7 OUTLIER -65.36 124.84 88.17 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.736 -179.824 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -41.05 -45.89 5.17 Favored 'Trans proline' 0 C--N 1.312 -1.378 0 C-N-CA 122.397 2.065 . . . . 0.0 112.08 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 51.15 93.75 0.01 OUTLIER Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 78' ' ' ASP . 73.3 m-20 -141.59 -114.99 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.942 0.401 . . . . 0.0 110.662 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.53 ' C ' ' O ' ' A' ' 77' ' ' ASN . 4.2 p-10 27.76 84.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -86.91 -78.92 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.096 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 62.48 159.89 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.1 0.476 . . . . 0.0 111.045 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.6 mt 70.99 105.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.657 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.07 166.39 24.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.569 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 28.7 m -144.26 150.55 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.48 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.95 -74.54 0.54 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 70.59 10.77 7.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.85 0.357 . . . . 0.0 110.344 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -125.91 164.03 21.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.574 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 54.35 45.39 27.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.33 20.6 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.71 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.452 HG23 ' N ' ' A' ' 90' ' ' ASN . 57.8 m -52.9 145.61 12.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.53 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.452 ' N ' HG23 ' A' ' 89' ' ' THR . 3.7 t-20 -161.27 36.6 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.86 171.54 17.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.988 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.63 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 2.7 tt 171.4 163.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.904 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.63 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 2.3 m-20 47.37 -176.85 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.281 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.421 HD11 ' N ' ' A' ' 95' ' ' THR . 2.9 pp -149.93 -6.86 0.32 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.19 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.644 ' C ' ' H ' ' A' ' 97' ' ' ASP . 10.1 t -87.53 -33.04 19.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.357 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.45 ' O ' ' CB ' ' A' ' 97' ' ' ASP . . . 57.13 -4.3 0.05 OUTLIER Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.644 ' H ' ' C ' ' A' ' 95' ' ' THR . 1.3 p30 165.01 145.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.667 0.27 . . . . 0.0 110.616 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.7 151.12 30.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.652 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.569 ' NZ ' ' CB ' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -88.76 1.97 54.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.592 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 100' ' ' ASP . 12.8 t0 -71.84 -15.91 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.22 -57.35 13.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.789 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 105' ' ' ALA . 3.0 pp -69.03 -42.09 76.82 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.423 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.496 ' H ' ' HG ' ' A' ' 102' ' ' LEU . 2.0 tp60 -50.4 -19.38 0.83 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.507 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.1 ttm180 -86.27 -32.65 20.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.398 -1.273 . . . . 0.0 110.003 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -56.47 -56.84 16.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.427 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' ' 107' ' ' ALA . 0.6 OUTLIER -77.53 -33.61 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.318 -179.217 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.462 ' N ' HD12 ' A' ' 106' ' ' ILE . . . -62.59 -59.87 4.32 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.283 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.542 ' O ' ' CB ' ' A' ' 111' ' ' ALA . 4.8 tp -53.83 -35.68 61.72 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.15 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.514 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.6 t -64.27 -52.62 57.71 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -48.12 -18.58 0.21 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.542 ' CB ' ' O ' ' A' ' 108' ' ' LEU . . . -72.67 -53.92 10.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.817 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -46.51 -23.08 0.33 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -86.15 -44.19 12.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.88 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.448 ' ND2' ' HD2' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -53.62 -9.7 0.22 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.531 ' H ' ' C ' ' A' ' 113' ' ' SER . 2.1 mpt_? -101.61 -46.31 5.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.823 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.59 -7.48 20.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.862 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -154.58 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.252 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.63 ' O ' ' N ' ' A' ' 120' ' ' THR . 37.8 mtt180 57.38 29.85 17.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.44 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.2 72.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.63 ' N ' ' O ' ' A' ' 118' ' ' ARG . 3.8 t -56.48 107.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.277 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -100.71 134.43 11.69 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.588 ' O ' ' CB ' ' A' ' 123' ' ' THR . 0.5 OUTLIER -60.65 -26.53 38.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.785 0.326 . . . . 0.0 110.563 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.588 ' CB ' ' O ' ' A' ' 122' ' ' ILE . 1.6 m 89.59 -142.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.56 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.541 ' O ' ' OD1' ' A' ' 124' ' ' ASP . 0.0 OUTLIER 50.79 11.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.443 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.508 ' H ' ' C ' ' A' ' 123' ' ' THR . 2.8 tp10 -58.74 -40.45 83.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.627 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -59.02 -37.98 78.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.601 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -73.36 -38.16 65.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.511 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.35 -54.62 43.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.688 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.414 HG13 ' N ' ' A' ' 130' ' ' SER . 31.7 pt -59.39 -36.32 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.6 m -63.38 -74.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.502 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 130' ' ' SER . 2.3 tpp180 -33.8 -65.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.387 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 133' ' ' LEU . 79.5 t -39.48 -61.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.526 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.456 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER -35.53 -51.74 0.64 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.514 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.606 ' C ' ' H ' ' A' ' 136' ' ' SER . 48.6 mt-10 -63.55 -64.68 0.83 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.579 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.59 9.49 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.721 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.606 ' H ' ' C ' ' A' ' 134' ' ' GLU . 13.5 t -126.17 -11.25 6.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.635 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.558 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.2 tt -108.37 -12.16 10.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.421 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 139' ' ' GLU . . . -45.04 -13.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.612 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 137' ' ' ILE . 4.1 tt0 -31.54 -57.7 0.27 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.604 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -116.4 132.55 56.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.722 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -178.2 146.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.369 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -125.75 122.18 35.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.767 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.54 94.7 3.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.346 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.78 144.78 37.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -167.24 86.68 0.27 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.477 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.633 -179.972 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.43 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.503 ' O ' ' C ' ' A' ' 3' ' ' VAL . 55.1 m -85.28 -78.71 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.731 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.503 ' C ' ' O ' ' A' ' 2' ' ' THR . 1.3 m -29.84 133.54 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.5 ' O ' ' C ' ' A' ' 5' ' ' GLN . 7.8 tt0 -173.79 119.82 0.29 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.5 ' C ' ' O ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -30.6 133.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.894 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -84.27 108.95 17.42 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -136.12 168.05 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.401 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.74 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -111.08 -15.86 13.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.923 0.392 . . . . 0.0 110.257 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.472 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.3 mt-30 -87.48 145.17 26.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.138 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.413 ' OE1' ' N ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER 59.29 16.96 5.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.225 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 85.7 p -67.9 74.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.776 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.79 -53.92 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.64 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -57.05 3.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -48.98 -18.29 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.672 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -24.83 59.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -58.39 -40.73 83.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.164 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -49.87 -41.49 45.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.26 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.422 ' NE2' ' H ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -45.56 -58.37 3.45 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.912 -179.354 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -58.92 -48.15 82.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.058 0.456 . . . . 0.0 111.312 -179.222 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.518 ' N ' ' CG2' ' A' ' 19' ' ' THR . 22.8 t80 -49.3 -59.0 4.09 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.953 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 mt -61.8 -39.43 91.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.029 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.666 ' OD1' ' NH2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -53.41 -40.81 65.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.647 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.6 mt-30 -59.58 -52.08 67.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.575 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.478 ' O ' ' CG2' ' A' ' 28' ' ' THR . 9.9 mt -44.35 -36.58 2.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.588 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.666 ' NH2' ' OD1' ' A' ' 22' ' ' ASN . 2.1 ttm105 -77.43 -19.26 56.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.715 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.4 tt0 -87.62 -58.59 2.52 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.476 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -60.77 -59.8 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.313 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.478 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -85.08 -3.08 58.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.42 -178.725 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 60.66 30.81 73.23 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.214 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.488 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 17.1 mm -82.84 147.41 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 117.213 0.507 . . . . 0.0 110.56 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -104.8 -50.67 3.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.99 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -43.36 103.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.548 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.411 ' H ' ' HG1' ' A' ' 33' ' ' THR . 16.6 p -68.59 -25.53 64.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.14 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -64.65 -44.86 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.97 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.98 -25.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.451 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.469 HD22 ' N ' ' A' ' 36' ' ' LEU . 4.6 mt -69.81 -50.18 45.52 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.877 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.46 -32.05 69.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.093 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -72.74 -38.18 67.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.332 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.505 ' O ' ' OG ' ' A' ' 43' ' ' SER . . . -63.98 -34.7 78.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.469 HD13 ' CD1' ' A' ' 20' ' ' PHE . 3.6 tt -65.85 -44.83 84.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.162 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.9 mmtp -59.17 -34.77 72.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.74 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.512 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -86.2 -13.46 46.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.662 ' HG ' ' CA ' ' A' ' 50' ' ' ALA . 14.4 m -97.13 -30.34 13.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.315 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.476 ' CB ' ' O ' ' A' ' 43' ' ' SER . 5.7 t30 77.73 24.38 0.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.134 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.12 8.68 47.0 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -97.17 130.95 44.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.507 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.3 OUTLIER -82.54 -63.55 1.35 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.426 -178.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -45.44 -21.5 0.1 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.651 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 3.2 mm? -87.97 -45.64 10.05 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.662 ' CA ' ' HG ' ' A' ' 43' ' ' SER . . . -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.702 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 4.2 p -59.87 -61.13 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.735 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -46.55 -42.33 15.7 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.159 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.448 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -52.7 -28.83 23.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.81 178.692 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 51' ' ' VAL . 6.2 mt -83.18 -49.19 9.72 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.48 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.35 -50.31 9.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.047 0.451 . . . . 0.0 109.889 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -40.92 157.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.449 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -115.83 -145.03 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.232 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.432 ' CG ' ' H ' ' A' ' 59' ' ' ALA . 3.7 t-20 -115.13 -144.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.726 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.432 ' H ' ' CG ' ' A' ' 58' ' ' ASN . . . 70.33 -152.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.561 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.11 173.18 0.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.805 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.535 ' N ' ' CD ' ' A' ' 62' ' ' PRO . 9.0 t -174.71 48.48 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 61' ' ' THR . 38.9 Cg_endo -71.03 -33.18 12.19 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.581 2.188 . . . . 0.0 111.606 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -62.66 -40.57 97.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.269 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.515 ' O ' ' O ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -124.98 95.1 4.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.309 179.721 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.515 ' O ' ' O ' ' A' ' 64' ' ' GLN . 5.5 mt-10 -38.4 165.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.051 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.537 ' O ' ' C ' ' A' ' 67' ' ' THR . 8.4 tp10 -125.56 -20.58 4.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.382 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.537 ' C ' ' O ' ' A' ' 66' ' ' GLU . 33.8 p 28.07 94.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.771 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.526 ' CG2' ' H ' ' A' ' 69' ' ' TYR . 6.0 m -62.19 -130.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.344 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.526 ' H ' ' CG2' ' A' ' 68' ' ' THR . 68.6 m-85 53.1 -164.59 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.606 ' O ' ' C ' ' A' ' 71' ' ' GLN . 58.7 t80 66.15 -80.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.606 ' C ' ' O ' ' A' ' 70' ' ' TYR . 6.7 tp-100 -8.81 -91.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.562 0.539 . . . . 0.0 111.244 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.491 ' CG2' ' N ' ' A' ' 73' ' ' ALA . 52.4 m -61.55 -103.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.195 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.491 ' N ' ' CG2' ' A' ' 72' ' ' THR . . . 59.71 135.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.4 tp -159.09 98.09 1.64 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.135 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.78 71.22 5.56 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.301 2.001 . . . . 0.0 112.527 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -86.1 161.64 34.64 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.499 ' H ' HD21 ' A' ' 77' ' ' ASN . 1.3 p30 -84.2 90.6 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.771 0.32 . . . . 0.0 110.529 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.61 172.56 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.44 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -96.94 136.5 37.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.661 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -46.24 -46.18 17.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.633 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.12 96.11 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.562 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.7 m -115.82 -10.43 11.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.881 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.18 44.61 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.603 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.437 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . -89.98 -92.37 1.21 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.437 ' CB ' ' O ' ' A' ' 84' ' ' GLY . 3.0 t 75.92 15.15 2.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.792 0.329 . . . . 0.0 110.72 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -105.92 -89.01 0.44 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.615 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.98 134.58 50.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.671 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.568 ' O ' ' O ' ' A' ' 89' ' ' THR . 12.6 m-20 -108.43 94.44 5.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.301 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.568 ' O ' ' O ' ' A' ' 88' ' ' ASP . 2.4 t -23.46 143.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.813 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.533 ' O ' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -157.24 4.37 0.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.532 ' O ' ' CB ' ' A' ' 92' ' ' ILE . 1.2 m -85.89 156.67 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.886 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.642 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 1.5 tt 157.28 164.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.851 178.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.642 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 1.6 p30 179.09 105.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.366 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.629 ' H ' ' CD1' ' A' ' 94' ' ' LEU . 0.6 OUTLIER -86.77 -25.56 24.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.721 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 t -99.17 -16.89 18.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.62 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.522 ' C ' ' OD1' ' A' ' 97' ' ' ASP . . . 51.76 48.38 50.66 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.2 OUTLIER 69.84 125.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 0.0 110.516 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.12 94.11 4.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.443 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' HZ1' ' HG3' ' A' ' 99' ' ' LYS . 27.5 mmtp -92.13 -45.58 8.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.457 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.22 -33.65 43.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.585 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -72.5 -19.61 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.563 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.592 ' C ' ' N ' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -75.55 -53.41 8.67 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.484 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.432 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -43.91 -19.39 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.755 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.592 ' N ' ' C ' ' A' ' 102' ' ' LEU . 9.6 mtp180 -87.22 -39.21 15.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.391 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -52.88 -57.24 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.433 ' CD1' ' H ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -64.83 -55.35 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 CA-C-O 121.602 0.715 . . . . 0.0 110.339 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.01 -46.15 5.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.652 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.24 -46.52 88.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.848 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.519 ' C ' ' N ' ' A' ' 111' ' ' ALA . 6.7 t -68.43 -53.21 25.14 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.616 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 tp -47.48 -17.77 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.519 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -79.99 -56.96 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.576 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -46.32 -24.25 0.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.624 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.649 ' O ' ' N ' ' A' ' 115' ' ' ARG . 58.2 m -90.54 -47.73 7.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.178 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 113' ' ' SER . 16.0 m120 -39.54 -19.14 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.075 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.649 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -112.86 -28.85 7.59 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.547 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -97.59 2.04 49.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.236 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.606 ' N ' ' O ' ' A' ' 113' ' ' SER . 3.5 t80 -91.14 -66.31 0.94 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.239 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.601 ' H ' ' HD2' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -38.0 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.869 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 65.32 66.47 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.567 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.5 t -76.13 80.84 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.458 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -154.55 115.24 0.66 Allowed Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tt -128.46 145.58 35.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.722 0.296 . . . . 0.0 110.389 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 30.2 m -106.4 -1.81 22.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.866 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.19 -24.16 57.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.624 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.583 ' OE1' ' N ' ' A' ' 126' ' ' GLU . 2.4 tm-20 -58.13 -57.01 14.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.472 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.583 ' N ' ' OE1' ' A' ' 125' ' ' GLU . 20.2 tt0 -48.78 -43.04 37.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.268 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.66 -45.93 92.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.255 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.44 -59.39 4.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.377 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.5 mm -42.78 -55.65 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.781 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.05 -52.09 12.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.736 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -46.6 -48.49 19.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.93 -54.66 28.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.786 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.413 ' N ' HD22 ' A' ' 133' ' ' LEU . 4.0 mm? -49.7 -44.29 48.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.68 -61.24 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -41.98 -30.13 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.448 ' C ' ' H ' ' A' ' 138' ' ' ALA . 1.6 t -71.32 -67.83 0.49 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.492 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.8 pt -65.1 -0.3 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.503 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.448 ' H ' ' C ' ' A' ' 136' ' ' SER . . . -107.47 12.16 28.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.757 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.49 ' CG ' ' H ' ' A' ' 140' ' ' ASN . 0.6 OUTLIER -117.23 -133.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.737 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.49 ' H ' ' CG ' ' A' ' 139' ' ' GLU . 10.8 t-20 -134.63 152.42 51.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.657 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 15.2 mtmm -82.66 -120.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.601 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.605 ' C ' ' SG ' ' A' ' 143' ' ' CYS . . . -90.04 -138.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.728 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.605 ' SG ' ' C ' ' A' ' 142' ' ' ALA . 2.7 m 82.07 52.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.622 ' C ' ' H ' ' A' ' 146' ' ' ARG . 2.8 mt -156.39 -49.8 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.718 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -66.36 16.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.815 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.622 ' H ' ' C ' ' A' ' 144' ' ' LEU . 80.1 mtt-85 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.503 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -157.74 37.32 0.27 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.77 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.4 t -52.95 96.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.799 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -115.11 140.43 49.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.182 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.515 ' O ' ' OD1' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -154.04 -141.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 0.0 110.978 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.515 ' OD1' ' O ' ' A' ' 5' ' ' GLN . 0.5 OUTLIER 160.83 -173.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.323 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 p 178.82 142.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.83 0.348 . . . . 0.0 110.82 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.465 ' CD2' ' H ' ' A' ' 9' ' ' GLN . 0.4 OUTLIER -168.32 156.93 8.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.644 179.717 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 18.7 tt0 -126.31 -143.14 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.088 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.46 ' H ' ' HG2' ' A' ' 9' ' ' GLN . 0.0 OUTLIER 69.93 131.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.733 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -168.27 1.8 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.563 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.73 -56.44 3.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.641 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.37 -56.44 3.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.705 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -48.37 -22.23 0.66 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.187 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.7 tttt -49.04 -25.62 2.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.116 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -73.51 -59.17 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.512 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.425 ' O ' ' CD1' ' A' ' 21' ' ' LEU . 0.8 OUTLIER -59.57 -29.9 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 179.152 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.595 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 4.7 mt-30 -71.64 -25.22 62.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.316 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -71.08 -51.38 25.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.228 0.537 . . . . 0.0 110.484 -179.527 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.595 ' N ' ' CG2' ' A' ' 19' ' ' THR . 42.6 t80 -60.02 -53.92 52.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.032 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.425 ' CD1' ' O ' ' A' ' 17' ' ' GLN . 13.3 mt -59.8 -45.75 91.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.148 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.595 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -50.05 -49.7 50.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.462 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.601 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.3 mm100 -54.9 -56.05 23.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.92 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.459 ' HA ' ' CD1' ' A' ' 27' ' ' ILE . 1.1 tp -44.92 -28.79 0.71 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.319 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -87.59 -24.26 24.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.152 0.501 . . . . 0.0 109.939 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' A' ' 23' ' ' GLN . 62.6 tt0 -88.25 -56.67 3.22 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.459 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -52.88 -59.6 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.427 -176.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.527 ' OG1' ' CD1' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -87.2 -6.49 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.742 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.99 9.9 67.33 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.35 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.527 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 2.0 mm -59.43 153.31 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 117.666 0.733 . . . . 0.0 110.287 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.41 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 4.4 p30 -113.47 -42.74 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.854 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.1 m-20 -44.89 101.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.557 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.9 m -67.13 -31.51 72.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.191 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.421 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.3 OUTLIER -65.02 -37.03 86.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.857 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.421 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 42.8 mm -67.24 -39.75 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.907 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 39' ' ' ALA . 7.2 mt -61.19 -60.71 3.34 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.378 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -45.61 -32.87 2.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.041 0.448 . . . . 0.0 110.276 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -81.43 -30.48 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.544 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -74.87 -24.11 58.51 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.605 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 2.0 tm? -77.68 -42.6 34.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.009 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -62.2 -43.22 99.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.532 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.598 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 80.4 m-20 -86.19 -22.45 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 39' ' ' ALA . 1.7 t -63.93 -30.96 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.629 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.598 ' ND2' ' O ' ' A' ' 42' ' ' ASP . 0.9 OUTLIER 79.88 9.26 1.47 Allowed 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.901 -0.319 . . . . 0.0 110.496 -179.37 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.15 15.45 25.84 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.488 ' O ' ' OG ' ' A' ' 43' ' ' SER . 0.6 OUTLIER -104.85 131.07 52.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.637 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.461 HD22 ' CE2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -78.96 -61.07 2.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.006 -178.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -54.01 -25.84 23.25 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.635 ' CD2' ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -88.53 -25.98 22.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.115 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.635 ' N ' ' CD2' ' A' ' 49' ' ' LEU . . . -79.85 -54.21 6.04 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.55 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 11.6 p -44.11 -40.18 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.641 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -64.9 -33.64 76.5 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.425 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.634 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.7 OUTLIER -54.35 -33.1 58.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.523 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.75 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -87.59 -52.48 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.836 -179.082 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.695 ' O ' ' N ' ' A' ' 57' ' ' LYS . 2.8 p -70.12 -43.19 71.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.313 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.641 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -22.45 -39.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.734 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.695 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -101.92 -69.98 0.76 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.609 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.414 ' O ' ' CB ' ' A' ' 59' ' ' ALA . 0.9 OUTLIER -148.81 -177.59 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.504 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.414 ' CB ' ' O ' ' A' ' 58' ' ' ASN . . . 167.67 139.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.813 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.591 ' O ' ' OG1' ' A' ' 61' ' ' THR . 16.0 tttt -150.9 136.15 17.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.591 ' OG1' ' O ' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -176.55 78.12 0.26 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.452 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -83.04 -18.82 6.06 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.035 2.49 . . . . 0.0 112.275 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -55.6 -32.75 63.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.751 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.48 67.94 4.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.641 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -117.9 64.12 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.603 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.588 ' O ' ' OG1' ' A' ' 67' ' ' THR . 9.5 mp0 -106.2 104.56 14.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.698 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 66' ' ' GLU . 2.5 m -174.06 -3.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.225 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.455 ' CG2' ' N ' ' A' ' 69' ' ' TYR . 6.5 t -62.52 -41.1 98.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.588 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 70' ' ' TYR . 66.9 t80 61.73 112.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.498 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.6 ' O ' ' CD2' ' A' ' 69' ' ' TYR . 1.4 p90 -54.56 179.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.668 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.518 ' O ' ' O ' ' A' ' 72' ' ' THR . 0.0 OUTLIER -117.29 44.41 2.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.51 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.518 ' O ' ' O ' ' A' ' 71' ' ' GLN . 68.0 p 37.36 97.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.503 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.64 -100.4 0.3 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.423 HD21 ' N ' ' A' ' 76' ' ' GLY . 4.0 tt -132.55 95.8 19.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.443 ' C ' ' H ' ' A' ' 77' ' ' ASN . 62.3 Cg_exo -46.53 -29.06 6.92 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.524 2.149 . . . . 0.0 112.166 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.427 ' O ' ' C ' ' A' ' 77' ' ' ASN . . . 66.47 -2.18 4.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.653 ' OD1' ' N ' ' A' ' 78' ' ' ASP . 51.0 t-20 37.84 -138.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.515 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.653 ' N ' ' OD1' ' A' ' 77' ' ' ASN . 3.8 p30 -148.29 108.73 4.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.668 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.43 ' O ' ' C ' ' A' ' 80' ' ' TYR . 11.3 mmm180 -83.37 -27.52 29.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.615 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.43 ' C ' ' O ' ' A' ' 79' ' ' ARG . 7.6 m-85 -36.44 -46.64 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.963 -179.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.02 90.6 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.06 -153.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.124 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.0 m -84.89 172.96 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.39 79.21 0.02 OUTLIER Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.2 p -116.87 -64.1 1.36 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.446 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -130.22 -137.68 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.5 ' C ' ' H ' ' A' ' 89' ' ' THR . . . -168.21 116.16 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.706 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.427 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 2.1 m-20 -74.49 34.74 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . 0.5 ' H ' ' C ' ' A' ' 87' ' ' ALA . 0.1 OUTLIER -111.01 153.2 25.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.613 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 89' ' ' THR . 0.6 OUTLIER -179.7 35.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.196 0.522 . . . . 0.0 109.601 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.16 175.7 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.251 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.633 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 2.4 tt 177.6 164.23 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.975 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.633 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 76.9 m-20 51.74 175.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.382 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -129.25 -27.87 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.592 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.9 t -91.19 -35.55 14.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.82 -17.21 20.49 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 58.28 30.53 19.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 110.45 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -84.46 86.86 7.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.671 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -12.53 61.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.598 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -15.81 61.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.502 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -32.38 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.851 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.436 ' HG ' ' N ' ' A' ' 103' ' ' GLN . 1.1 pp -65.54 -33.2 75.36 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.436 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -57.69 -19.32 26.23 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.043 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -87.11 -29.22 22.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.166 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.96 -57.8 10.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.239 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.448 HD11 ' N ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -71.79 -35.31 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.712 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.448 ' N ' HD11 ' A' ' 106' ' ' ILE . . . -57.38 -52.54 64.94 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.2 -38.87 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.557 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.473 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -70.33 -42.89 71.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.232 179.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.4 mp -48.55 -19.14 0.3 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.473 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.1 2.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.406 179.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -47.43 -20.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.942 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.603 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.6 OUTLIER -88.51 -51.75 5.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.007 179.634 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 114' ' ' ASN . 62.1 t-20 -45.99 -12.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.603 ' H ' ' C ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -101.56 -37.72 8.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.602 179.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.509 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -92.9 15.17 15.44 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.058 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.52 ' CE2' ' O ' ' A' ' 118' ' ' ARG . 3.3 p90 -58.38 164.52 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.692 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.52 ' O ' ' CE2' ' A' ' 117' ' ' PHE . 28.5 mtm180 -54.92 94.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.459 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.481 ' CA ' ' OE1' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -83.73 36.98 0.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.958 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.795 ' HG1' ' H ' ' A' ' 121' ' ' GLY . 0.0 OUTLIER -77.05 -103.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.44 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . 0.795 ' H ' ' HG1' ' A' ' 120' ' ' THR . . . 69.7 61.7 4.25 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.685 ' O ' ' N ' ' A' ' 124' ' ' ASP . 1.2 tt -163.84 145.42 2.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.716 0.293 . . . . 0.0 110.535 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.543 ' C ' ' O ' ' A' ' 122' ' ' ILE . 43.7 m -28.29 84.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.529 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.685 ' N ' ' O ' ' A' ' 122' ' ' ILE . 0.2 OUTLIER -63.62 171.22 2.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.539 -179.783 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -68.81 -55.99 9.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.34 -40.6 65.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.392 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -25.9 65.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.72 -57.48 3.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.702 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.2 mt -53.8 -45.56 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.677 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 131' ' ' ARG . 1.4 t -60.54 -64.97 0.77 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.671 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 130' ' ' SER . 5.7 mtp85 -38.54 -49.95 1.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.48 ' O ' ' OG ' ' A' ' 136' ' ' SER . 46.6 t -58.75 -51.32 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.721 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.4 ' O ' ' OG ' ' A' ' 136' ' ' SER . 5.0 mt -43.46 -57.46 3.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.758 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.434 ' C ' ' OE1' ' A' ' 134' ' ' GLU . 11.8 tm-20 -53.11 -57.33 10.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.586 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -50.91 -26.18 5.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 132' ' ' VAL . 0.2 OUTLIER -74.76 -62.69 1.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.54 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 1.9 pt -66.96 -6.67 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.748 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.56 61.52 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.666 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.574 ' O ' ' O ' ' A' ' 140' ' ' ASN . 1.3 tp10 -94.59 -75.33 0.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.6 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.574 ' O ' ' O ' ' A' ' 139' ' ' GLU . 0.3 OUTLIER 43.15 105.74 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.638 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.502 ' O ' ' C ' ' A' ' 142' ' ' ALA . 31.7 mttm -77.19 46.82 0.52 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.574 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . -32.11 97.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.653 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.443 ' N ' ' O ' ' A' ' 141' ' ' LYS . 4.0 m -156.45 152.84 27.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . 0.57 ' O ' ' O ' ' A' ' 145' ' ' LYS . 4.0 mm? -72.54 171.54 12.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.711 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . 0.57 ' O ' ' O ' ' A' ' 144' ' ' LEU . 10.7 ttmm 25.81 99.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.867 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 13.1 ptt-85 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.51 179.869 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.0 mtt . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.516 ' O ' ' C ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -94.95 78.53 3.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.398 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.516 ' C ' ' O ' ' A' ' 2' ' ' THR . 10.3 p -28.32 100.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.619 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.18 22.95 7.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.638 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -134.89 -107.9 0.22 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.388 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.78 88.83 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.814 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -131.15 -22.02 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.363 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.6 ' CD2' ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -57.07 -52.91 63.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.62 -31.02 72.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -63.52 -179.52 0.36 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.3 t -130.8 -64.71 0.82 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.608 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.439 ' O ' ' N ' ' A' ' 14' ' ' GLN . . . -72.71 -49.7 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.688 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -45.01 -20.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.632 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 12' ' ' ALA . 14.0 tm0? -50.18 -18.55 0.6 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.353 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 pttm -52.14 -19.15 1.79 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.713 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -75.24 -24.45 57.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -46.93 -31.41 3.13 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.396 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.6 OUTLIER -46.59 -41.88 15.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.364 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.459 HG21 ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -68.04 -40.18 82.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.533 0.682 . . . . 0.0 109.651 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.47 ' CE1' ' HB2' ' A' ' 40' ' ' LEU . 10.0 t80 -57.82 -56.25 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.934 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.1 mt -64.22 -45.76 86.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.974 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.512 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 14.0 t-20 -46.45 -38.72 9.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -42.99 84.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.741 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.47 ' O ' ' CG2' ' A' ' 28' ' ' THR . 20.3 mt -54.45 -58.66 6.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -59.03 -18.09 31.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.278 0.561 . . . . 0.0 109.702 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -76.94 -44.73 30.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.288 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.544 HD13 ' H ' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -91.38 -41.31 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.423 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.51 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.8 t -95.18 -4.73 45.44 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.941 -177.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.52 31.52 66.99 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.41 -0.424 . . . . 0.0 112.449 178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.504 HG23 HD11 ' A' ' 30' ' ' ILE . 47.1 mm -90.07 112.39 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.586 -0.445 . . . . 0.0 110.056 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.494 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.5 p30 -76.66 -41.7 44.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.16 90.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.411 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -58.03 -37.09 73.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.772 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.37 -44.12 84.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.031 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.445 HG22 HD13 ' A' ' 35' ' ' ILE . 38.3 mm -67.88 -28.85 42.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.253 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.33 -51.78 33.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.166 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -53.22 -27.29 21.16 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -79.39 -25.18 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.326 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.98 -40.01 32.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.246 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.648 ' C ' ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.77 -29.7 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.019 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.474 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -69.7 -43.92 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.766 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.47 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.7 m-20 -74.55 -19.31 60.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.776 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.589 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -82.97 -30.79 27.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.928 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.589 ' OD1' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 80.66 23.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.095 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.52 8.63 42.98 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.548 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.1 m120 -96.58 130.75 43.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.514 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.1 OUTLIER -83.46 -63.05 1.43 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.402 ' C ' ' O ' ' A' ' 47' ' ' LEU . 21.2 tt0 -45.56 -21.82 0.12 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.665 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.8 mm? -85.87 -42.89 13.72 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.31 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.467 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -61.11 -56.74 17.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.637 ' CG1' ' H ' ' A' ' 52' ' ' ALA . 1.1 p -50.16 -65.17 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.658 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -45.83 -42.26 12.14 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.037 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -54.78 -31.11 58.41 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 51' ' ' VAL . 3.3 mt -87.15 -50.23 6.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.293 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.412 ' H ' HG21 ' A' ' 55' ' ' THR . 10.6 p -67.26 -50.55 60.08 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -47.74 -60.3 2.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.503 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.7 tptt 63.67 113.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.388 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -137.46 44.66 2.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.712 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 69.3 127.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.892 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.631 ' O ' ' CB ' ' A' ' 61' ' ' THR . 23.4 tptt -128.69 -81.5 0.58 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.646 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.631 ' CB ' ' O ' ' A' ' 60' ' ' LYS . 1.3 m 92.04 63.71 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.13 0.491 . . . . 0.0 110.573 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.476 ' HD3' ' H ' ' A' ' 61' ' ' THR . 84.9 Cg_endo -86.05 -4.48 8.77 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 123.38 2.72 . . . . 0.0 111.843 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -40.03 -79.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.698 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -126.07 69.95 1.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.644 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -126.9 57.11 1.47 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.451 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -155.52 128.57 8.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.562 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.9 t -173.15 -13.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.235 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.9 t -158.99 -152.17 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.229 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.525 ' CD2' ' O ' ' A' ' 69' ' ' TYR . 22.2 p90 -153.89 110.84 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.699 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.559 ' O ' ' O ' ' A' ' 71' ' ' GLN . 0.3 OUTLIER -128.52 -60.19 1.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.544 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.559 ' O ' ' O ' ' A' ' 70' ' ' TYR . 0.9 OUTLIER -38.29 167.77 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.783 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.405 ' C ' ' O ' ' A' ' 71' ' ' GLN . 73.7 p 38.99 68.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.329 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.71 2.34 41.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.76 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.06 122.36 74.69 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.139 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.74 47.97 0.76 Allowed 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.11 1.873 . . . . 0.0 112.205 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 80.16 -167.8 51.32 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -97.87 -124.23 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.93 0.395 . . . . 0.0 110.712 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -170.78 149.74 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.515 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.499 ' O ' ' C ' ' A' ' 80' ' ' TYR . 12.2 mtt180 -72.23 72.13 0.9 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.567 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.499 ' C ' ' O ' ' A' ' 79' ' ' ARG . 0.2 OUTLIER -32.81 -59.04 0.35 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.337 179.879 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 134.89 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.31 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.486 ' O ' ' C ' ' A' ' 83' ' ' VAL . 1.4 p -173.54 -48.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.618 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . 0.486 ' C ' ' O ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -32.3 115.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.691 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.4 -68.07 1.08 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.661 ' O ' ' CB ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER 168.53 -84.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.545 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 85' ' ' SER . 5.3 tp-100 139.43 -70.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.987 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.521 ' O ' ' C ' ' A' ' 88' ' ' ASP . . . 55.09 -127.81 2.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.521 ' C ' ' O ' ' A' ' 87' ' ' ALA . 46.1 t0 30.59 67.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.561 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.8 m -159.42 121.18 3.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.724 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -171.45 7.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.268 0.556 . . . . 0.0 109.584 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.567 ' O ' ' O ' ' A' ' 92' ' ' ILE . 0.3 OUTLIER -58.99 -91.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.308 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.567 ' O ' ' O ' ' A' ' 91' ' ' VAL . 0.4 OUTLIER 33.12 -162.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.521 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.544 ' N ' ' CG2' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -141.15 147.06 37.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.663 -179.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.7 -28.8 6.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -108.22 -38.11 5.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.875 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 51.37 54.68 22.87 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -166.31 155.5 11.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 0.0 110.656 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.1 157.56 10.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.544 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.4 mtmm -95.82 -19.09 19.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.596 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -86.99 -47.43 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.791 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.426 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER -51.19 -33.97 29.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.964 0.412 . . . . 0.0 110.281 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.434 ' N ' HD21 ' A' ' 102' ' ' LEU . 4.2 mm? -55.38 -33.77 63.73 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 120.417 -0.513 . . . . 0.0 109.658 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.463 ' O ' ' CB ' ' A' ' 107' ' ' ALA . 21.3 tp60 -55.18 -19.74 8.67 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.426 ' CB ' ' O ' ' A' ' 101' ' ' ASP . 23.7 ttt180 -85.92 -32.57 21.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.354 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.68 -57.8 11.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.547 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.459 HD11 ' N ' ' A' ' 107' ' ' ALA . 0.7 OUTLIER -74.24 -31.86 30.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 CA-C-O 121.087 0.47 . . . . 0.0 111.188 -179.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 103' ' ' GLN . . . -62.15 -52.18 64.86 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.25 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.3 mp -57.83 -38.7 76.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.987 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.503 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -72.36 -54.66 8.8 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.191 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -47.49 -17.93 0.11 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -85.88 -47.72 9.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.301 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 116' ' ' ALA . 4.8 mm-40 -45.05 -22.53 0.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.643 ' O ' ' N ' ' A' ' 115' ' ' ARG . 62.0 m -92.55 -54.63 3.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.86 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -41.3 -13.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.138 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.643 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -121.33 -32.91 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.17 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.426 ' CB ' ' O ' ' A' ' 112' ' ' GLU . . . -80.48 -7.63 59.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.483 ' N ' ' O ' ' A' ' 113' ' ' SER . 55.7 t80 -58.19 -110.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.444 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.451 ' N ' ' CG ' ' A' ' 117' ' ' PHE . 18.3 mtm180 -133.12 42.18 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.564 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.68 33.5 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.555 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 30.4 p -67.01 178.85 1.27 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.558 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 65.22 112.12 0.01 OUTLIER Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.64 ' C ' ' H ' ' A' ' 124' ' ' ASP . 2.5 tp -91.72 25.36 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.821 0.343 . . . . 0.0 110.514 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 122' ' ' ILE . 5.9 p 59.53 -6.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.611 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.653 ' N ' ' OD1' ' A' ' 124' ' ' ASP . 0.2 OUTLIER 37.36 83.45 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.539 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.505 ' H ' ' CD ' ' A' ' 125' ' ' GLU . 1.1 pm0 -70.83 -53.95 13.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.522 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -54.89 -44.77 74.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.516 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.02 -31.11 72.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.546 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -59.4 -75.67 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.397 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.52 ' CG2' ' N ' ' A' ' 130' ' ' SER . 18.9 tt -44.58 -45.67 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.319 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.52 ' N ' ' CG2' ' A' ' 129' ' ' ILE . 4.0 p -57.55 -40.95 79.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.28 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -47.54 63.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.195 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -56.16 -43.51 76.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.123 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.39 -56.52 16.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.209 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.47 -37.34 56.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.315 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -24.1 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.466 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.62 ' O ' ' CB ' ' A' ' 138' ' ' ALA . 49.7 mm -85.14 -28.14 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.511 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.62 ' CB ' ' O ' ' A' ' 137' ' ' ILE . . . 90.35 58.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -50.93 -2.23 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.229 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . 0.617 ' H ' ' C ' ' A' ' 138' ' ' ALA . 17.4 t30 -83.08 73.59 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.641 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 141' ' ' LYS . 1.1 mptm? -36.94 146.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.575 ' O ' ' O ' ' A' ' 143' ' ' CYS . . . -80.94 107.33 13.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' CYS . . . . . 0.575 ' O ' ' O ' ' A' ' 142' ' ' ALA . 0.1 OUTLIER 46.46 110.29 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -42.72 -58.95 2.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.315 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -176.2 77.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.526 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.463 HH11 ' HD3' ' A' ' 146' ' ' ARG . 7.0 mtp180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.561 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 121.024 0.44 . . . . 0.0 109.856 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -60.43 -54.19 48.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.539 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.623 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -62.73 -51.5 66.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.725 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.623 ' N ' ' CG2' ' A' ' 19' ' ' THR . 55.9 t80 -55.75 -53.02 61.72 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.143 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' A' ' 37' ' ' GLN . 27.9 mt -62.56 -48.45 79.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.287 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 9.9 m-20 -50.22 -43.55 52.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.246 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.4 mt-30 -56.73 -53.54 56.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.087 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 54' ' ' LEU . 11.7 mt -43.29 -35.39 1.47 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 123.336 0.397 . . . . 0.0 110.779 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -76.42 -21.41 56.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.174 0.511 . . . . 0.0 109.79 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.664 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.8 tt0 -87.36 -58.49 2.56 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.537 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -59.18 -59.6 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.431 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.6 OUTLIER -82.65 -2.84 55.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 -178.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.42 25.02 59.99 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.768 HG22 ' H ' ' A' ' 32' ' ' ASP . 3.3 mm -69.28 159.78 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.131 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.474 ' N ' HG22 ' A' ' 30' ' ' ILE . 17.2 m-20 -132.36 22.25 4.39 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.283 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.768 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -103.85 121.19 42.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.611 ' O ' ' NE2' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -82.07 -26.48 33.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.249 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.538 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 8.1 mm100 -83.96 -46.75 11.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 0.0 111.151 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 35' ' ' ILE . 6.3 mm -66.8 -20.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.081 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -74.12 -63.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.064 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.611 ' NE2' ' O ' ' A' ' 33' ' ' THR . 3.6 pt20 -50.86 -25.0 3.98 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -75.47 -38.99 59.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.388 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.408 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -65.34 -19.15 65.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.895 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.485 HD13 ' CE2' ' A' ' 20' ' ' PHE . 12.2 tp -79.14 -52.99 7.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.603 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -51.81 -33.77 37.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -27.77 27.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.59 ' OG ' ' N ' ' A' ' 50' ' ' ALA . 3.6 m -80.51 -30.65 37.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.815 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.92 35.05 16.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.289 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.33 4.63 50.04 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.681 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.425 ' ND2' ' O ' ' A' ' 43' ' ' SER . 6.6 m-80 -93.8 130.96 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -84.76 -62.62 1.5 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.71 -178.013 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -52.75 -21.87 4.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.025 0.441 . . . . 0.0 110.289 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -81.49 -54.85 5.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.199 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.59 ' N ' ' OG ' ' A' ' 43' ' ' SER . . . -52.44 -36.75 55.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.479 ' O ' HG22 ' A' ' 55' ' ' THR . 1.0 OUTLIER -63.26 -49.53 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.34 177.697 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.446 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -57.0 -44.13 82.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.785 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -60.55 -24.56 65.48 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.863 -0.735 . . . . 0.0 110.816 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.575 ' CD1' HD22 ' A' ' 24' ' ' LEU . 68.6 mt -87.37 -53.57 4.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.744 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.479 HG22 ' O ' ' A' ' 51' ' ' VAL . 12.9 t . . . . . 0 C--N 1.329 -0.32 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.448 ' N ' ' OD1' ' A' ' 101' ' ' ASP . 1.0 OUTLIER . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.075 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.831 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -56.12 -35.65 67.32 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.581 -179.382 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.455 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 2.1 tt0 -53.91 -19.51 4.66 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.441 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.1 ttt180 -86.54 -33.05 20.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.857 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.55 -53.97 49.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.159 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.476 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.68 -47.33 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.352 0.596 . . . . 0.0 110.573 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.82 -57.34 7.56 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.158 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -46.59 -44.75 18.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.102 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.467 ' C ' ' N ' ' A' ' 111' ' ' ALA . 8.7 t -63.87 -44.43 93.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.218 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -48.61 -19.02 0.3 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.45 -57.99 2.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.65 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -47.77 -18.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.307 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.435 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.627 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.414 ' CD ' ' N ' ' A' ' 126' ' ' GLU . 1.9 pp20? . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' A' ' 125' ' ' GLU . 1.8 tt0 -55.42 -53.26 58.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.862 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.51 -27.67 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.632 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 130' ' ' SER . . . -72.91 -84.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.619 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.544 ' C ' ' O ' ' A' ' 128' ' ' ALA . 2.6 mt -26.9 -39.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.77 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.59 ' N ' ' O ' ' A' ' 128' ' ' ALA . 9.1 m -62.43 -68.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.645 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -43.49 -25.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.677 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 41.7 t -75.42 -62.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.447 ' C ' ' O ' ' A' ' 132' ' ' VAL . 14.5 mt -37.55 -56.18 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 135' ' ' ALA . 39.9 tt0 -56.09 -41.21 74.83 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.875 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -36.4 -61.0 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -60.21 -43.34 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.12 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.462 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -81.03 -42.06 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.215 0.531 . . . . 0.0 110.853 -179.592 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.462 ' N ' ' CG2' ' A' ' 19' ' ' THR . 29.4 t80 -56.84 -56.86 16.17 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.564 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.0 mt -64.46 -39.91 94.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.105 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.62 -40.73 75.87 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.07 -47.5 80.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.056 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.541 HD11 ' HB1' ' A' ' 50' ' ' ALA . 14.7 mt -51.16 -53.57 33.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.179 0.514 . . . . 0.0 110.644 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.668 ' C ' ' HE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -60.07 -16.57 32.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.26 0.553 . . . . 0.0 109.593 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -82.08 -57.47 3.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.542 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -78.27 -46.81 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.365 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.542 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.0 t -92.35 -3.17 55.75 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.665 -177.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.57 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . 62.72 -7.6 0.25 Allowed Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.708 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.537 HG13 HD23 ' A' ' 54' ' ' LEU . 41.1 mm -59.17 97.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 117.911 0.856 . . . . 0.0 110.301 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 29' ' ' GLY . 3.8 m-20 -83.06 36.56 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.134 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -106.91 85.56 2.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.9 0.381 . . . . 0.0 110.114 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -43.7 -37.05 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.019 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -47.22 83.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.656 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.7 mp -75.62 -33.08 25.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.657 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.548 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.8 mt -65.35 -63.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -51.3 -28.13 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.097 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -78.21 -39.43 40.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.84 82.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.048 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.2 tm? -67.93 -43.05 80.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.79 -40.26 20.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.577 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.5 t0 -87.3 -40.19 14.7 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.602 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -63.87 -24.29 67.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.465 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.682 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 1.4 p-10 50.35 42.15 25.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.558 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.64 -1.39 49.13 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.063 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.602 ' O ' ' OG ' ' A' ' 43' ' ' SER . 5.0 m-20 -96.85 122.8 40.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 50' ' ' ALA . 21.6 tp -84.99 -61.79 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.248 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.539 ' C ' HD22 ' A' ' 49' ' ' LEU . 5.3 mt-10 -42.73 -21.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.774 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -89.61 -39.3 13.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.618 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -67.38 -54.83 17.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.755 HG13 ' N ' ' A' ' 52' ' ' ALA . 10.1 p -53.46 -53.16 26.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.755 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.54 -45.02 66.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.455 -1.248 . . . . 0.0 109.586 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -49.18 -27.81 3.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.636 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.2 mp -85.86 -52.42 5.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.737 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 55' ' ' THR . 2.6 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.479 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.714 0.292 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.668 HD22 ' H ' ' A' ' 102' ' ' LEU . 2.4 mm? -73.02 -46.43 52.1 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.118 0.485 . . . . 0.0 109.84 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 20.6 tp60 -44.99 -20.11 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.538 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.2 ttt-85 -85.69 -45.79 11.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.116 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -53.97 -47.42 71.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.87 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.2 mm -62.28 -57.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 121.668 0.747 . . . . 0.0 109.924 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -45.31 -44.02 11.2 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.055 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.31 -39.23 66.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.148 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.464 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.7 OUTLIER -73.49 -46.73 46.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.238 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 110' ' ' LEU . 1.6 mm? -48.39 -17.89 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.464 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -87.99 -58.41 2.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.572 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -47.58 -24.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.929 179.364 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.857 0.361 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.4 -49.65 76.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.631 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.42 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.1 OUTLIER -67.78 -30.33 69.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.521 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.48 73.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.541 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.8 mt -59.76 -58.21 8.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.587 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.91 -37.94 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.497 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.66 -56.65 18.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.533 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 132' ' ' VAL . 4.1 t -44.38 -36.01 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.52 ' O ' ' C ' ' A' ' 134' ' ' GLU . 2.4 mp -67.69 -89.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.966 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.52 ' C ' ' O ' ' A' ' 133' ' ' LEU . 31.4 mt-10 -33.58 -49.72 0.31 Allowed 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.449 ' C ' ' O ' ' A' ' 134' ' ' GLU . . . -37.44 -69.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.479 ' O ' ' OG ' ' A' ' 136' ' ' SER . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.873 0.368 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -59.89 -55.09 38.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.622 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.601 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -68.51 -48.36 64.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.297 0.57 . . . . 0.0 110.313 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.601 ' N ' ' CG2' ' A' ' 19' ' ' THR . 40.0 t80 -47.35 -60.28 2.61 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.972 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.86 -52.07 65.64 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.956 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -45.14 -32.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.692 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -71.87 -48.8 43.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.882 179.191 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 1.057 HD21 ' HB1' ' A' ' 50' ' ' ALA . 1.9 mp -45.24 -25.67 0.4 Allowed 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.426 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -88.38 -24.39 23.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.766 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.692 ' N ' ' O ' ' A' ' 23' ' ' GLN . 5.6 tm-20 -86.84 -57.77 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.35 -59.68 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.113 -177.492 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.5 -5.14 58.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.787 -179.186 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.35 32.65 76.01 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.209 -0.519 . . . . 0.0 111.893 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.407 HG22 ' N ' ' A' ' 31' ' ' ASN . 3.1 mm -88.25 153.58 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.66 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.589 ' N ' ' OD1' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -108.08 -54.57 2.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.907 -179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.618 ' HB2' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -41.24 101.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.353 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.3 m -66.7 -24.81 66.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.164 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -69.04 -51.71 36.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.756 0.312 . . . . 0.0 110.857 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.618 HD12 ' HB2' ' A' ' 32' ' ' ASP . 69.8 mt -53.21 -20.59 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.603 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -80.18 -60.66 2.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.725 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -43.38 -25.2 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.574 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 1.5 tt0 -79.22 -39.87 32.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.004 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -63.18 -36.4 83.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.817 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.79 HD23 ' O ' ' A' ' 40' ' ' LEU . 7.0 tt -66.57 -40.45 88.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.005 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -52.83 -39.19 62.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.024 0.44 . . . . 0.0 109.891 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.4 m-20 -86.76 -30.0 21.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.502 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 0.1 OUTLIER -79.38 -21.47 45.68 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.083 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 40' ' ' LEU . 36.3 m120 62.21 29.85 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.939 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.45 1.42 53.53 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.502 ' N ' ' OG ' ' A' ' 43' ' ' SER . 5.2 m-20 -88.07 130.65 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.257 . . . . 0.0 110.378 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.478 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -83.98 -63.39 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.242 -178.681 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.562 ' C ' HD22 ' A' ' 49' ' ' LEU . 11.9 mt-10 -45.66 -22.4 0.17 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.42 0.629 . . . . 0.0 109.533 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.799 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -89.71 -41.17 12.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.316 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 1.057 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -63.23 -46.89 84.8 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.803 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.9 p -58.75 -59.12 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.803 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -50.07 -40.19 44.63 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.458 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -53.93 -32.84 54.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.161 179.096 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.568 HD12 ' O ' ' A' ' 50' ' ' ALA . 5.4 mp -85.76 -51.95 6.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.354 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 51' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.112 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.9 t0 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.782 0.325 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.4 tt -71.86 -54.46 10.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.209 0.528 . . . . 0.0 110.292 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.411 ' N ' HD23 ' A' ' 102' ' ' LEU . 26.4 tp60 -43.96 -17.96 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 178.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.599 ' N ' ' C ' ' A' ' 102' ' ' LEU . 3.6 tpt180 -86.69 -37.72 17.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.372 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -59.93 -38.75 83.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.206 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.483 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -75.06 -37.25 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.555 0.693 . . . . 0.0 110.023 179.536 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -56.87 14.09 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.123 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 12.2 tp -48.48 -53.94 16.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.116 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 105' ' ' ALA . 0.7 OUTLIER -57.69 -49.28 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.833 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.7 mt -48.32 -17.93 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.33 -54.55 5.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.612 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.481 ' CD ' ' N ' ' A' ' 112' ' ' GLU . 0.3 OUTLIER -46.6 -23.13 0.35 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.903 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.742 0.306 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -58.31 -36.58 73.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -77.55 -51.02 11.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.748 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.83 -44.36 39.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.553 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.41 -62.1 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.508 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.27 -16.84 9.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.813 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.1 ttt-85 -76.03 -52.15 10.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.615 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 48.3 t -64.55 -52.93 48.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.406 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 133' ' ' LEU . 0.9 OUTLIER -47.69 -52.88 16.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.572 179.902 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -51.64 -52.1 50.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.402 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.37 -13.07 2.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.415 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.462 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.762 0.315 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -55.36 -44.98 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.53 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.528 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -69.25 -43.5 73.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.644 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 40' ' ' LEU . 38.3 t80 -50.96 -58.15 6.76 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.431 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.47 -42.27 96.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.004 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.59 -41.29 41.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.528 ' OE1' ' O ' ' A' ' 19' ' ' THR . 0.8 OUTLIER -60.31 -46.54 89.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.095 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 28' ' ' THR . 40.9 mt -50.35 -57.95 6.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 109.927 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.429 ' CG ' ' O ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.07 -17.31 38.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.209 0.528 . . . . 0.0 109.752 179.333 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -78.86 -48.77 14.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.714 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.57 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -89.86 -46.92 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.162 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 24' ' ' LEU . 2.8 t -87.39 -2.84 58.9 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.373 -177.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.06 32.44 71.07 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.698 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.598 ' HB ' HD21 ' A' ' 36' ' ' LEU . 40.3 mm -89.77 128.65 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.281 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -94.03 -47.94 6.46 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.304 -179.244 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -41.07 98.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.576 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -77.11 -39.95 47.63 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.732 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.47 HG22 ' CD2' ' A' ' 54' ' ' LEU . 34.2 mm -72.46 -21.26 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 24' ' ' LEU . 87.8 mt -76.0 -63.51 1.3 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.271 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.04 -26.0 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -73.53 -37.45 65.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.632 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.585 ' O ' ' OD1' ' A' ' 42' ' ' ASP . . . -60.37 -42.6 96.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.732 179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.053 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.68 -36.06 79.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.379 179.575 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -53.44 -41.15 65.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.025 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.7 ' OD1' ' CD2' ' A' ' 53' ' ' PHE . 7.1 p30 -87.25 -23.96 24.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.478 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.583 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.4 OUTLIER -77.52 -7.52 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.686 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.692 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 56.77 25.22 9.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.214 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.43 ' HA2' HD13 ' A' ' 40' ' ' LEU . . . 102.45 -5.87 52.3 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.58 ' O ' ' OG ' ' A' ' 43' ' ' SER . 87.8 m-20 -84.39 131.6 34.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 49' ' ' LEU . 13.2 tp -83.25 -64.11 1.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.52 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.458 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.1 tt0 -42.34 -21.02 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.691 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -88.0 -45.84 9.86 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.844 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.626 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -55.2 -53.06 60.83 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.928 HG13 ' H ' ' A' ' 52' ' ' ALA . 3.9 p -57.19 -62.86 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.558 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.928 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.24 -35.22 3.22 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.242 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.7 ' CD2' ' OD1' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -64.35 -30.37 71.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.141 179.027 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 24' ' ' LEU . 9.3 mt -87.87 -43.83 11.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.387 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.2 t . . . . . 0 C--N 1.33 -0.248 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.004 -179.626 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.6 t70 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.705 0.288 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 104' ' ' ARG . 1.2 tp -71.37 -53.67 13.35 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.15 0.5 . . . . 0.0 110.696 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.421 ' C ' ' O ' ' A' ' 102' ' ' LEU . 26.1 tp60 -43.83 -18.6 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.588 ' N ' ' O ' ' A' ' 102' ' ' LEU . 1.4 mtp180 -86.64 -38.96 16.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.609 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -54.28 -57.78 9.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.398 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.517 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.64 -57.22 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.756 0.788 . . . . 0.0 109.868 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -44.09 -39.61 4.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.343 -1.299 . . . . 0.0 110.128 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.65 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.3 OUTLIER -59.15 -44.23 92.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.923 179.482 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.45 ' C ' ' N ' ' A' ' 111' ' ' ALA . 2.7 t -68.4 -48.34 64.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.51 -17.25 0.76 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.65 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -80.19 -58.85 2.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.039 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -46.82 -25.81 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.864 179.186 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.797 0.332 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -39.54 74.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.221 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.513 ' C ' ' CD ' ' A' ' 127' ' ' GLN . 0.7 OUTLIER -71.18 -35.71 71.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.907 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.4 -70.98 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.364 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.4 mt -44.68 -39.14 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.4 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 t -55.69 -56.69 17.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.412 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 27.7 ttt-85 -52.3 -51.69 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.05 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.592 ' O ' ' OG ' ' A' ' 136' ' ' SER . 33.2 t -47.46 -71.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.162 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.513 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.1 OUTLIER -30.03 -68.78 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.317 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.619 ' C ' ' H ' ' A' ' 136' ' ' SER . 29.2 tt0 -48.29 -59.85 3.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.717 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.18 4.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.694 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.619 ' H ' ' C ' ' A' ' 134' ' ' GLU . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.658 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.653 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 8.6 mp0 . . . . . 0 N--CA 1.457 -0.109 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 4.4 mm100 -64.19 -56.52 14.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.191 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.606 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -75.53 -47.99 24.46 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.331 0.586 . . . . 0.0 110.533 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.606 ' N ' ' CG2' ' A' ' 19' ' ' THR . 61.4 t80 -46.79 -50.56 18.09 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.204 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.583 HD21 ' HA ' ' A' ' 37' ' ' GLN . 54.0 mt -69.33 -52.02 31.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.157 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 9.5 t30 -45.17 -37.9 4.85 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.635 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -61.63 -55.72 27.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.881 178.364 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 36' ' ' LEU . 9.0 mt -45.82 -21.87 0.15 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.256 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -87.9 -23.4 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.137 179.275 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.635 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.6 tt0 -87.53 -58.22 2.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.82 -59.89 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.444 -177.475 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -84.59 -5.51 59.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 -179.278 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.75 32.6 74.37 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.204 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 31' ' ' ASN . 4.4 mm -89.77 161.23 2.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.963 0.382 . . . . 0.0 110.986 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' HG22 ' A' ' 30' ' ' ILE . 23.5 m-20 -125.15 -21.13 4.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.524 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.453 ' CB ' HD12 ' A' ' 35' ' ' ILE . 3.8 m-20 -67.2 124.68 23.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.532 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m -82.89 -21.96 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.351 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -43.0 19.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.644 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.453 HD12 ' CB ' ' A' ' 32' ' ' ASP . 62.0 mt -60.85 -43.9 96.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.913 0.387 . . . . 0.0 110.459 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 24' ' ' LEU . 75.9 mt -70.26 -56.78 5.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.583 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -45.59 -27.07 0.69 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.822 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.468 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -71.43 -39.55 70.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.135 178.828 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.55 -25.44 65.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.838 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.894 ' C ' HD13 ' A' ' 40' ' ' LEU . 1.2 tm? -72.64 -46.38 54.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.104 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.594 ' N ' HD13 ' A' ' 40' ' ' LEU . 19.8 mmmt -58.64 -31.77 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.658 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.86 -48.33 8.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.607 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 44' ' ' ASN . 88.8 p -63.61 -5.91 4.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.679 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.738 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.2 OUTLIER 59.51 28.6 18.03 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.264 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.28 -11.65 54.92 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.687 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.715 ' OD1' ' ND2' ' A' ' 44' ' ' ASN . 10.8 m120 -85.31 131.88 34.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.054 0.427 . . . . 0.0 110.253 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 50' ' ' ALA . 65.7 tp -81.71 -61.29 1.97 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.211 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.536 ' C ' HD22 ' A' ' 49' ' ' LEU . 1.4 mt-10 -40.89 -25.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.055 0.455 . . . . 0.0 109.81 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.3 mm? -90.05 -35.24 15.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.59 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -63.79 -52.2 61.33 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.79 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.5 p -56.64 -56.48 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.79 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.71 -36.17 56.92 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.462 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -54.19 -31.66 53.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.918 178.922 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.595 HD22 HG21 ' A' ' 28' ' ' THR . 8.0 mp -78.68 -55.36 5.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.222 0 CA-C-O 121.223 0.535 . . . . 0.0 109.687 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 p30 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.785 0.326 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 105' ' ' ALA . 5.1 tt -73.02 -50.08 25.13 Favored 'General case' 0 CA--C 1.51 -0.561 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.1 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.656 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.5 mt-30 -46.01 -20.12 0.08 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 178.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.533 ' N ' ' C ' ' A' ' 102' ' ' LEU . 0.8 OUTLIER -87.1 -31.53 20.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.436 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.611 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.1 -57.29 13.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.259 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -74.05 -34.1 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.15 -179.308 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.769 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -61.51 -58.22 9.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.71 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.659 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 36.8 mt -47.27 -44.79 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.781 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.488 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -61.27 -46.2 91.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.056 179.542 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.51 -18.54 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -82.3 -55.47 4.5 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.533 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -45.95 -22.72 0.22 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.45 ' N ' ' C ' ' A' ' 111' ' ' ALA . 19.1 m . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.142 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.7 0.286 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.84 -39.8 62.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.432 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -68.94 -34.08 74.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.68 -70.38 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.768 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.0 pp -39.49 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.798 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.1 m -72.43 -78.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.899 0.381 . . . . 0.0 110.89 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.612 ' CA ' ' HE ' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -25.74 -56.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.324 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 133' ' ' LEU . 7.2 p -57.72 -69.72 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.345 -179.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.991 ' H ' HG13 ' A' ' 132' ' ' VAL . 0.5 OUTLIER -42.34 -54.19 3.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.811 0.338 . . . . 0.0 110.654 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -41.18 -51.5 3.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.598 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.6 -23.58 59.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 133' ' ' LEU . 74.6 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 . . . . . 0 CA--C 1.523 -0.061 0 CA-C-O 120.763 0.316 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -46.65 -50.95 16.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.397 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.576 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -72.6 -49.33 32.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.194 0.521 . . . . 0.0 110.872 -179.62 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.576 ' N ' ' CG2' ' A' ' 19' ' ' THR . 35.1 t80 -46.46 -58.91 3.32 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.9 mt -66.26 -49.84 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.217 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -45.54 -40.35 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 26' ' ' GLU . 13.2 mm-40 -61.46 -50.09 74.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.765 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.616 HD21 ' CB ' ' A' ' 50' ' ' ALA . 29.9 mt -44.28 -30.95 0.89 Allowed 'General case' 0 C--O 1.226 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.132 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.49 ' CD ' ' C ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -84.59 -18.99 33.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.08 0.467 . . . . 0.0 110.031 179.232 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.674 ' N ' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -87.4 -55.03 3.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.674 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.513 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -62.27 -59.58 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -177.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -89.15 -3.72 58.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.577 -178.088 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.437 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 66.08 32.68 83.15 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.304 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.681 ' O ' HD11 ' A' ' 36' ' ' LEU . 39.5 mm -106.97 107.48 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 117.449 0.625 . . . . 0.0 110.945 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.659 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -79.91 -20.11 46.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.678 -179.474 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 55.3 m-20 -44.51 84.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.224 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.659 ' N ' ' O ' ' A' ' 31' ' ' ASN . 8.6 t -51.79 -24.47 6.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.866 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.488 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.67 -40.65 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.187 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.488 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 10.7 mt -75.36 -29.41 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.086 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.681 HD11 ' O ' ' A' ' 30' ' ' ILE . 3.2 mt -70.2 -44.81 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.527 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 2.7 pt20 -64.19 -28.75 69.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.386 . . . . 0.0 110.147 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 46.6 tt0 -79.59 -38.29 34.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.05 69.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.503 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -77.06 -40.33 46.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.127 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.732 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.64 -35.64 70.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.7 OUTLIER -86.09 -46.23 10.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.034 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.623 ' O ' ' N ' ' A' ' 45' ' ' GLY . 5.8 m -66.26 18.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.962 0.41 . . . . 0.0 111.01 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.595 ' H ' ' C ' ' A' ' 42' ' ' ASP . 4.5 p-10 31.77 28.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.108 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.623 ' N ' ' O ' ' A' ' 43' ' ' SER . . . 97.5 26.53 9.89 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.945 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 43' ' ' SER . 8.0 m120 -108.68 131.0 55.34 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.513 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.56 -63.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.728 -177.745 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.575 ' C ' HD22 ' A' ' 49' ' ' LEU . 52.4 tt0 -49.13 -20.83 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.795 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.1 mm? -89.44 -52.57 4.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.486 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.616 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -53.81 -47.77 70.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.684 HG13 ' N ' ' A' ' 52' ' ' ALA . 6.5 p -62.96 -50.71 78.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.119 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.684 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -60.33 -28.72 68.37 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.669 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.502 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.7 OUTLIER -61.91 -37.16 83.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.048 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.551 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -71.4 -57.62 4.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.433 HG22 ' H ' ' A' ' 55' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.936 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.817 0.341 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.649 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.3 mt -66.67 -51.84 51.61 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.012 0.434 . . . . 0.0 110.693 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 102' ' ' LEU . 5.4 tp60 -43.82 -18.85 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.6 ' N ' ' O ' ' A' ' 102' ' ' LEU . 3.5 ttp180 -86.76 -35.45 19.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.166 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.649 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -67.39 -47.99 68.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.117 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.759 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.83 -32.81 59.67 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.214 0.531 . . . . 0.0 110.451 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.81 -52.6 23.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.451 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 63.1 tp -46.33 -53.0 11.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.644 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.483 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER -63.79 -46.68 84.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.421 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.04 -17.46 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.95 -58.42 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.782 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -46.23 -22.4 0.23 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.86 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.429 ' N ' ' C ' ' A' ' 111' ' ' ALA . 8.6 t . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.502 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.789 0.328 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.03 -53.12 42.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.74 -39.26 90.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.543 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -63.16 -69.37 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.484 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 128' ' ' ALA . 5.0 mm -37.86 -48.34 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.696 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -60.72 2.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HD2' HH11 ' A' ' 131' ' ' ARG . 3.9 mmt180 -59.08 -55.77 30.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' A' ' 135' ' ' ALA . 82.9 t -48.02 -66.39 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.425 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.75 ' O ' HD23 ' A' ' 133' ' ' LEU . 5.3 tt -34.57 -48.87 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.631 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.551 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -62.51 -30.89 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.692 -179.915 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -46.8 -32.4 3.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.385 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.603 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -69.37 -49.83 51.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.461 0.648 . . . . 0.0 110.081 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.603 ' N ' ' CG2' ' A' ' 19' ' ' THR . 74.9 t80 -60.1 -49.52 77.31 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.604 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -39.55 89.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.16 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 12.0 t30 -59.25 -39.37 82.63 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.7 mm-40 -56.83 -51.64 68.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.138 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.666 ' HB3' HD22 ' A' ' 36' ' ' LEU . 4.5 mt -45.75 -41.26 10.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.332 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.661 ' NH2' ' OE1' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -69.7 -18.45 63.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.717 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.661 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 1.3 tp10 -85.89 -58.43 2.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.519 ' CD1' ' H ' ' A' ' 27' ' ' ILE . 0.1 OUTLIER -64.43 -59.41 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.902 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.493 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -83.24 -2.91 56.77 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.501 -178.734 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 62.7 20.23 61.54 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.032 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.673 HG21 HD21 ' A' ' 36' ' ' LEU . 9.1 mm -65.62 160.36 3.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 117.094 0.447 . . . . 0.0 110.628 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.537 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 5.6 t-20 -117.12 -56.92 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.298 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.474 ' HB3' HD12 ' A' ' 35' ' ' ILE . 1.1 t0 -48.53 111.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.621 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.2 p -71.99 -19.88 61.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.728 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -70.65 -43.08 69.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.594 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' A' ' 32' ' ' ASP . 90.9 mt -62.05 -40.85 88.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.554 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.673 HD21 HG21 ' A' ' 30' ' ' ILE . 16.3 mt -60.45 -62.1 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.451 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -43.41 -28.05 0.32 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.404 ' N ' ' C ' ' A' ' 36' ' ' LEU . 2.1 tp60 -76.09 -38.96 56.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.854 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.558 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.42 -38.07 84.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.075 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -62.29 -37.26 84.85 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.488 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.9 -43.38 94.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.067 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -78.67 -46.07 19.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.147 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.6 p -66.63 -31.57 72.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.307 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 67.3 47.08 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.728 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.587 ' H ' HD22 ' A' ' 40' ' ' LEU . . . 94.15 -14.33 65.52 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.02 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -80.12 124.94 29.21 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 49' ' ' LEU . 32.8 tp -85.02 -62.7 1.48 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.324 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 3.7 tt0 -42.44 -20.87 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.688 HD22 ' N ' ' A' ' 49' ' ' LEU . 4.0 mm? -86.3 -50.19 7.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.608 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.627 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -58.2 -56.82 17.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.647 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 3.7 p -49.67 -46.89 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.647 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -60.08 -36.29 77.04 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.401 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -64.39 -36.13 83.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.253 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 50' ' ' ALA . 4.4 mm? -69.34 -57.49 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.179 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 51' ' ' VAL . 9.9 t . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.391 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.594 ' OD2' ' NH2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.749 0.309 . . . . 0.0 110.573 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.843 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -60.57 -35.45 76.09 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 120.53 -0.468 . . . . 0.0 109.793 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.465 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.6 OUTLIER -56.25 -18.69 11.18 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.97 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.594 ' NH2' ' OD2' ' A' ' 101' ' ' ASP . 0.4 OUTLIER -82.38 -37.91 24.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.652 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.82 -49.02 76.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.98 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.465 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -62.25 -40.95 89.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 109.75 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.0 -48.15 76.41 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.526 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 108' ' ' LEU . 6.2 tp -55.89 -34.51 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.824 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.462 ' C ' ' N ' ' A' ' 111' ' ' ALA . 58.2 m -78.07 -49.69 13.48 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.575 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -48.06 -18.29 0.18 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.462 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.86 -58.25 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.457 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -46.25 -26.29 0.77 Allowed 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.452 ' N ' ' HG3' ' A' ' 112' ' ' GLU . 35.9 t . . . . . 0 C--N 1.322 -0.612 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.987 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.8 0.333 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 130' ' ' SER . 1.5 tt0 -53.26 -34.22 56.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.598 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.497 ' O ' ' OG ' ' A' ' 130' ' ' SER . 16.6 tt0 -65.91 -55.86 14.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.783 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -45.16 -64.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.6 mp -43.9 -39.36 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.525 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.31 -44.27 83.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 131' ' ' ARG . 7.6 tpt180 -50.33 -36.16 30.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.579 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.9 t -75.37 -62.91 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.49 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.9 mt -44.6 -42.94 7.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -51.57 56.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -74.84 5.61 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.018 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.451 ' HG2' ' N ' ' A' ' 18' ' ' GLN . 2.4 pt20 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.882 0.373 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.451 ' N ' ' HG2' ' A' ' 17' ' ' GLN . 5.1 mm-40 -47.13 -56.04 7.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -40.43 66.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.159 0.504 . . . . 0.0 110.326 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -45.47 -63.64 0.91 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.809 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.427 HD22 ' O ' ' A' ' 36' ' ' LEU . 37.8 mt -55.97 -45.12 79.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.253 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 3.4 t-20 -48.56 -43.69 35.85 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.461 0.648 . . . . 0.0 109.43 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.866 ' O ' HD12 ' A' ' 27' ' ' ILE . 26.0 mm-40 -60.64 -55.79 29.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.778 HD21 ' HB1' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -43.8 -19.3 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.768 179.612 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -85.31 -25.29 27.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.566 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.734 ' N ' ' O ' ' A' ' 23' ' ' GLN . 15.0 tt0 -87.06 -58.14 2.7 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.378 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 1.044 ' H ' HD12 ' A' ' 27' ' ' ILE . 2.4 mp -53.54 -60.7 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.536 ' OG1' HD11 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -88.53 -3.12 58.87 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.663 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.13 32.89 62.59 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.556 HG22 ' H ' ' A' ' 32' ' ' ASP . 27.9 mm -81.58 162.16 3.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.191 0.52 . . . . 0.0 111.725 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.525 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -151.27 33.66 0.58 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.525 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.556 ' H ' HG22 ' A' ' 30' ' ' ILE . 24.6 m-20 -111.6 142.81 43.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.325 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 m -83.03 -39.32 21.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.666 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -78.92 -52.05 8.82 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 35' ' ' ILE . 8.1 mm -57.11 -25.17 22.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.639 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -83.69 -26.68 29.61 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.516 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -81.64 -18.35 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -85.16 -32.24 22.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.513 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB2' HD11 ' A' ' 54' ' ' LEU . . . -74.12 -50.19 20.54 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.93 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.629 ' O ' HD12 ' A' ' 40' ' ' LEU . 4.0 tp -58.0 -41.41 83.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.797 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -61.95 -36.38 81.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.165 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.577 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 1.1 t0 -86.6 -20.16 28.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.152 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.543 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -82.96 -30.36 28.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.898 -179.776 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.49 ' CG ' ' C ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 72.9 34.21 1.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.977 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.49 2.15 68.06 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.543 ' O ' ' OG ' ' A' ' 43' ' ' SER . 52.6 m-20 -96.61 126.06 41.52 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -79.75 -64.02 1.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.54 -177.906 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 31.8 tt0 -43.2 -21.44 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.739 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.0 mm? -88.05 -43.83 11.41 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.689 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.778 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -60.21 -55.13 37.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.821 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.4 p -54.53 -57.34 6.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 121.856 0.836 . . . . 0.0 109.063 178.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.821 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -49.86 -42.09 46.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.875 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -52.09 -32.32 34.49 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.626 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 54' ' ' LEU . 7.8 mp -74.44 -57.74 3.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.128 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.348 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.532 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 6.1 t70 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 120.893 0.378 . . . . 0.0 110.421 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.63 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.6 OUTLIER -57.56 -47.87 80.88 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.145 0.497 . . . . 0.0 110.051 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 22.0 tt0 -44.98 -19.8 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.566 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.3 ttt180 -82.76 -37.86 24.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.768 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.63 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.9 -54.77 40.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.526 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -65.56 -36.41 77.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 121.371 0.605 . . . . 0.0 110.594 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -65.21 -40.9 94.77 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.44 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.806 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 6.4 tp -58.21 -45.97 86.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.408 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.9 OUTLIER -66.83 -55.88 12.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.277 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 110' ' ' LEU . 18.4 tp -47.62 -17.9 0.12 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.806 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -76.27 -58.29 3.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.597 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -49.9 -21.28 1.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.868 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.723 0.297 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.8 -35.34 69.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.882 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -81.62 -35.48 30.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.676 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 132' ' ' VAL . . . -71.09 -39.18 72.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.876 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.1 mm -78.0 -40.28 26.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.821 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.5 t -73.7 -22.02 60.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -56.9 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.583 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 128' ' ' ALA . 2.2 p -56.92 -37.54 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.596 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -63.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.456 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 134' ' ' GLU . 0.4 OUTLIER -45.63 -50.51 13.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.439 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.14 -42.52 66.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.675 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.458 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.721 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 1.3 pm0 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.754 0.311 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.662 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 77.4 mt-30 -53.82 -41.47 67.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.654 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -81.06 -44.78 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.148 0.499 . . . . 0.0 110.564 -179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.887 ' CD1' HD12 ' A' ' 40' ' ' LEU . 12.4 t80 -48.79 -60.68 2.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.84 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 37' ' ' GLN . 80.1 mt -58.58 -40.71 83.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.447 ' HB3' ' NE2' ' A' ' 23' ' ' GLN . 35.8 t-20 -54.18 -40.62 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.654 ' NE2' ' O ' ' A' ' 19' ' ' THR . 5.6 mm-40 -60.05 -52.96 63.15 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.623 HD21 ' HB1' ' A' ' 50' ' ' ALA . 10.4 mt -44.31 -22.4 0.07 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.208 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.444 ' N ' ' C ' ' A' ' 23' ' ' GLN . 19.3 ttm-85 -86.95 -27.2 23.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.257 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 23' ' ' GLN . 26.4 mt-10 -88.49 -55.75 3.59 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.414 1.265 . . . . 0.0 114.414 -177.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.52 -60.02 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.615 -176.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.576 HG21 HD22 ' A' ' 54' ' ' LEU . 0.4 OUTLIER -84.82 -4.52 59.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.693 -178.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.27 32.49 67.9 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.834 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.872 HD12 HD23 ' A' ' 54' ' ' LEU . 3.5 mt -98.96 145.47 10.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.77 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 33' ' ' THR . 15.0 m-20 -97.33 -44.46 6.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.51 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.82 88.45 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.554 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.575 ' N ' ' O ' ' A' ' 31' ' ' ASN . 19.1 p -60.92 -23.88 65.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.45 -44.75 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.05 0.453 . . . . 0.0 110.237 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.4 mt -73.87 -31.2 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.498 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.681 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.7 mt -70.59 -63.57 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.808 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.532 ' OE1' ' N ' ' A' ' 38' ' ' GLN . 0.0 OUTLIER -47.39 -35.48 8.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.103 0.478 . . . . 0.0 110.369 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 37' ' ' GLN . 2.3 tp-100 -73.34 -34.15 65.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.959 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.64 -44.56 95.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.683 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.887 HD12 ' CD1' ' A' ' 20' ' ' PHE . 3.2 tt -62.89 -44.46 96.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.952 0.406 . . . . 0.0 110.579 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.69 -33.55 66.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 m-20 -87.18 -23.35 24.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.888 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.666 ' O ' ' ND2' ' A' ' 46' ' ' ASN . 0.3 OUTLIER -88.96 -7.91 55.13 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.026 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 66.27 21.84 10.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.313 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.47 14.54 27.56 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.731 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.666 ' ND2' ' O ' ' A' ' 43' ' ' SER . 1.5 m-80 -107.95 127.39 53.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.505 HD22 ' CZ ' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -68.78 -62.81 1.23 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.517 ' C ' HD22 ' A' ' 49' ' ' LEU . 50.5 mt-10 -44.54 -21.69 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.012 0.434 . . . . 0.0 110.702 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.948 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -90.22 -39.44 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.684 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.623 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -64.45 -50.89 65.74 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.697 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.6 p -59.63 -49.43 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.368 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.697 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -61.53 -33.94 74.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.528 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -59.11 -28.35 66.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.287 179.312 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 30' ' ' ILE . 7.7 mp -80.53 -55.11 5.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.436 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 55' ' ' THR . 3.1 t . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.008 0.433 . . . . 0.0 110.126 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 t70 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.796 0.331 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.9 OUTLIER -77.19 -52.98 8.31 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.045 0.45 . . . . 0.0 110.669 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.424 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.3 mp0 -44.25 -18.82 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -85.97 -39.11 17.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.451 -1.249 . . . . 0.0 109.99 179.548 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -50.33 -57.39 8.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.521 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.514 ' H ' HD12 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -65.31 -54.68 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-O 121.566 0.698 . . . . 0.0 110.332 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.51 -60.23 1.83 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.51 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.465 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.4 OUTLIER -47.87 -40.11 20.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.3 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.497 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.1 OUTLIER -68.56 -45.33 72.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.473 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mp -48.46 -19.05 0.28 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.497 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.21 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.226 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -49.39 -19.61 0.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.016 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.414 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.672 0.272 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -53.53 45.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.453 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -64.51 -35.98 82.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.161 179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -59.22 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.175 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 129' ' ' ILE . 9.1 mm -35.76 -40.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.318 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 30.8 t -66.49 -69.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.497 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -42.15 -48.68 4.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.653 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 128' ' ' ALA . 13.7 t -57.22 -62.39 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.673 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.428 ' HA ' HD13 ' A' ' 133' ' ' LEU . 0.2 OUTLIER -41.38 -35.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.461 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -61.97 -49.05 77.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.535 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.07 -17.4 25.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.738 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.6 m . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.499 179.937 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.226 -0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.18 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -43.74 -58.33 2.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.48 -34.43 67.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.451 0.643 . . . . 0.0 110.648 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.603 ' CE2' HD13 ' A' ' 40' ' ' LEU . 1.1 t80 -50.72 -60.61 2.87 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.273 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 17' ' ' GLN . 2.0 mt -66.24 -47.19 74.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.117 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -48.71 -42.75 36.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.144 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -63.16 -53.64 50.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.001 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.645 ' HA ' HD11 ' A' ' 27' ' ' ILE . 26.4 mt -47.91 -26.1 1.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.4 ttm105 -85.38 -19.14 31.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.447 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 23' ' ' GLN . 7.0 tt0 -86.6 -58.53 2.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.859 HD13 ' H ' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -67.24 -54.8 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.548 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.609 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.3 t -87.75 -2.57 58.7 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.588 -176.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 60.83 4.66 4.48 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.622 -0.717 . . . . 0.0 113.67 177.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.573 HG22 ' H ' ' A' ' 32' ' ' ASP . 40.8 mm -65.99 125.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 118.077 0.939 . . . . 0.0 109.961 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -105.57 30.78 5.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.234 -179.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.573 ' H ' HG22 ' A' ' 30' ' ' ILE . 14.9 m-20 -100.7 88.85 3.71 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.4 m -53.84 -30.41 45.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.895 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -67.7 -51.89 44.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.498 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.81 -22.25 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.566 HD12 HD21 ' A' ' 54' ' ' LEU . 0.7 OUTLIER -73.71 -63.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.584 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -51.8 -27.53 12.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -73.82 -25.27 60.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.456 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.481 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -73.97 -35.37 64.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.006 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.603 HD13 ' CE2' ' A' ' 20' ' ' PHE . 14.1 tp -67.36 -47.75 69.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.399 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -59.78 -41.78 91.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.359 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.471 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -86.34 -15.65 39.85 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.116 -179.391 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.661 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -76.8 -31.21 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.483 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.571 ' OD1' ' O ' ' A' ' 43' ' ' SER . 0.5 OUTLIER 84.51 13.51 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.931 -179.529 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.21 13.37 31.26 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.112 -0.565 . . . . 0.0 112.388 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.781 ' HB2' HD22 ' A' ' 49' ' ' LEU . 10.0 m120 -107.92 130.67 55.01 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' A' ' 50' ' ' ALA . 53.7 tp -86.02 -64.76 1.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -177.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -46.44 -26.33 0.83 Allowed 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.678 0.751 . . . . 0.0 109.276 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -87.19 -29.85 21.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.387 179.322 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.838 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -74.26 -58.37 3.34 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' N ' ' A' ' 52' ' ' ALA . 14.5 p -43.63 -40.07 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.559 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -67.64 -27.89 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.252 -1.34 . . . . 0.0 110.392 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.696 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -60.0 -28.92 68.1 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.452 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.803 ' N ' HD12 ' A' ' 54' ' ' LEU . 5.6 mp -80.62 -53.51 6.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.299 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 51' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.025 179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 12.3 m-20 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.873 0.368 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.866 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.2 pp -56.03 -46.11 78.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.086 0.469 . . . . 0.0 110.16 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.866 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.14 -19.71 0.08 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.528 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.534 ' N ' ' C ' ' A' ' 102' ' ' LEU . 20.8 ttp85 -85.09 -37.04 20.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.968 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -62.95 -45.3 93.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.314 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.819 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -69.44 -32.66 53.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-O 121.236 0.541 . . . . 0.0 110.537 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.36 -60.29 3.58 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.237 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 30.7 mt -47.24 -42.58 20.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.521 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.454 ' C ' ' N ' ' A' ' 111' ' ' ALA . 81.2 p -72.69 -41.77 64.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.661 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 mt -48.2 -19.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.454 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -89.44 -58.59 2.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.24 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -48.21 -21.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.563 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.402 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.879 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.789 0.328 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -51.24 -48.74 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.7 -25.89 67.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.774 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -66.45 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.75 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.653 ' H ' HD12 ' A' ' 129' ' ' ILE . 2.6 mp -49.35 -33.07 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.845 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' CB ' ' A' ' 134' ' ' GLU . 0.0 OUTLIER -68.73 -25.3 64.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.747 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.5 mmm180 -85.26 -49.59 8.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -54.98 -40.99 56.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.503 ' N ' ' CG1' ' A' ' 132' ' ' VAL . 4.1 tp -80.55 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.544 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 130' ' ' SER . 1.4 tt0 -38.0 -31.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.362 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . -78.62 -52.5 8.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.57 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.804 ' N ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.069 0 CA-C-O 120.75 0.309 . . . . 0.0 110.728 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.65 ' N ' ' OE1' ' A' ' 18' ' ' GLN . 3.8 mp0 -61.52 -58.28 8.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.663 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.494 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -73.78 -34.92 64.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.446 0.641 . . . . 0.0 110.213 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' HD23 ' A' ' 40' ' ' LEU . 2.1 t80 -51.89 -60.77 2.79 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.91 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.9 mt -67.72 -31.99 72.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.983 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -60.11 -41.87 93.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 0.0 110.147 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.602 ' N ' ' OE1' ' A' ' 23' ' ' GLN . 1.3 mp0 -67.32 -50.18 61.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.109 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD22 ' A' ' 36' ' ' LEU . 12.6 mt -45.57 -31.82 2.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.33 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.1 ttt-85 -87.61 -20.62 26.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.908 0.385 . . . . 0.0 110.492 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.535 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.1 tt0 -87.58 -58.08 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.553 HD13 ' H ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -62.76 -44.59 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.196 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.553 ' H ' HD13 ' A' ' 27' ' ' ILE . 1.4 t -99.64 -2.68 34.89 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.676 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 63.65 19.33 62.62 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.453 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.525 ' HB ' HD21 ' A' ' 36' ' ' LEU . 7.1 mm -79.12 113.56 18.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.541 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -76.75 -50.77 12.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.788 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.7 m-20 -41.43 103.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.308 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.6 t -71.76 -27.22 62.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.737 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -59.64 -41.71 91.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.518 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.403 HG22 ' CD1' ' A' ' 54' ' ' LEU . 12.8 mm -68.38 -45.84 81.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.705 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.833 HD22 ' HB3' ' A' ' 24' ' ' LEU . 18.2 mt -63.98 -60.75 2.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.189 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 36' ' ' LEU . 4.9 mm-40 -43.46 -29.2 0.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.421 ' N ' ' C ' ' A' ' 36' ' ' LEU . 10.8 tt0 -78.87 -32.28 45.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.083 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -69.64 -33.79 73.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.796 ' C ' HD13 ' A' ' 40' ' ' LEU . 3.0 tm? -66.12 -38.28 87.79 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.093 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -71.13 -42.61 68.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.97 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.56 -24.13 25.57 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.861 0.363 . . . . 0.0 111.481 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.593 ' OG ' ' O ' ' A' ' 39' ' ' ALA . 6.9 p -62.82 -30.3 71.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.778 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.2 t-20 83.66 14.28 0.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.01 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.84 4.97 48.24 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.06 -0.59 . . . . 0.0 111.642 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.62 ' CB ' HD22 ' A' ' 49' ' ' LEU . 2.9 m120 -100.74 130.16 46.74 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.655 ' O ' ' N ' ' A' ' 50' ' ' ALA . 2.1 tt -85.75 -62.84 1.43 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.879 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.522 ' O ' HG13 ' A' ' 51' ' ' VAL . 3.5 mt-10 -41.4 -38.21 1.19 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.093 0.473 . . . . 0.0 110.393 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.959 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -81.13 -26.56 36.04 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.235 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.959 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -69.63 -58.46 3.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 52' ' ' ALA . 1.6 p -44.41 -44.96 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.74 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 177.339 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.56 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -61.73 -28.62 69.55 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.282 -1.781 . . . . 0.0 110.361 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.641 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -64.32 -29.51 70.59 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.509 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 54' ' ' LEU . 3.1 mm? -75.66 -57.59 3.79 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.287 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.1 t . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.683 179.605 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.1 t0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.916 0.389 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.642 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.8 OUTLIER -64.86 -52.92 54.02 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.064 0.459 . . . . 0.0 110.325 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.406 ' C ' ' O ' ' A' ' 102' ' ' LEU . 3.9 mm-40 -44.67 -18.33 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.583 ' N ' ' C ' ' A' ' 102' ' ' LEU . 13.5 tpp180 -84.54 -35.5 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.873 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.642 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.91 -40.71 94.19 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.481 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -67.75 -40.32 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.611 0.72 . . . . 0.0 109.772 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.91 75.28 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.214 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.8 OUTLIER -58.84 -41.05 86.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.133 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.458 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.3 m -72.91 -47.89 41.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.225 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.43 -18.58 0.24 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.458 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -84.99 -52.86 5.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.274 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -47.12 -20.96 0.19 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.519 . . . . 0.0 109.74 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.442 ' N ' ' C ' ' A' ' 111' ' ' ALA . 20.1 m . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.039 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE2' ' OE1' ' A' ' 126' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.656 0.265 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.568 ' OE1' ' OE2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -60.89 -31.59 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.988 0.423 . . . . 0.0 110.177 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.43 -37.41 65.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.458 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.06 -65.8 0.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.2 pt -46.68 -32.84 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.411 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -63.02 -37.98 89.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.638 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -65.76 -39.38 91.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.8 t -57.73 -57.69 9.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.635 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.0 mp -48.77 -59.45 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.691 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -52.53 -58.48 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -51.23 -32.49 24.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.85 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.86 -179.731 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.884 0.373 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -58.61 7.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.794 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -73.75 -41.26 62.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.334 0.588 . . . . 0.0 110.381 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.625 ' CE1' HD23 ' A' ' 40' ' ' LEU . 19.4 t80 -50.53 -61.02 2.44 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.142 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.674 HD21 ' HA ' ' A' ' 37' ' ' GLN . 17.8 mt -59.25 -49.93 75.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.145 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -44.74 -41.21 6.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.665 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -65.17 -52.48 54.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.866 179.025 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.747 HD21 ' HB1' ' A' ' 50' ' ' ALA . 11.2 mt -43.66 -28.07 0.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.824 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.36 -23.12 24.68 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.131 0.491 . . . . 0.0 109.742 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.665 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -88.02 -56.69 3.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.016 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.14 -59.53 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 121.016 0.436 . . . . 0.0 111.741 -176.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.837 ' OG1' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -81.35 -13.53 58.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.24 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.36 31.97 82.12 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.837 HD13 ' OG1' ' A' ' 28' ' ' THR . 0.4 OUTLIER -90.07 152.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.913 0.387 . . . . 0.0 110.532 -179.065 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 33' ' ' THR . 19.0 t-20 -105.15 -39.38 6.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.746 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB3' HD12 ' A' ' 35' ' ' ILE . 7.2 m-20 -48.75 85.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.21 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.587 ' N ' ' O ' ' A' ' 31' ' ' ASN . 18.0 p -60.8 -20.21 61.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.012 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -66.99 -49.61 64.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 110.971 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' HB3' ' A' ' 32' ' ' ASP . 3.3 mt -63.82 -31.23 52.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.137 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.638 ' CD2' HD21 ' A' ' 54' ' ' LEU . 8.8 mt -63.59 -61.78 2.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.758 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.674 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -48.7 -27.24 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.245 0.545 . . . . 0.0 109.59 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.491 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 16.4 mt-30 -80.4 -37.95 31.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.372 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.76 97.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.114 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.901 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -62.54 -42.29 99.43 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.713 ' N ' HD13 ' A' ' 40' ' ' LEU . 1.9 mmtp -52.22 -33.39 41.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.908 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.506 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.5 OUTLIER -86.74 -43.87 12.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.599 179.559 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.599 ' HG ' ' HZ ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -65.63 -29.54 70.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.466 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 43' ' ' SER . 4.4 p30 48.65 53.16 12.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.056 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.38 -9.42 57.49 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.547 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.562 ' O ' ' OG ' ' A' ' 43' ' ' SER . 4.9 m120 -96.0 116.39 28.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.007 0.404 . . . . 0.0 110.198 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -77.41 -63.82 1.29 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.476 -178.492 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.502 ' C ' HD22 ' A' ' 49' ' ' LEU . 24.9 tt0 -42.88 -20.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.743 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.6 mm? -87.69 -52.48 5.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.713 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.747 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -51.1 -47.15 62.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.949 HG13 ' H ' ' A' ' 52' ' ' ALA . 6.5 p -63.21 -62.66 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 CA-C-O 121.517 0.675 . . . . 0.0 109.219 178.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.949 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -47.36 -27.42 1.62 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.236 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -65.74 -38.02 88.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.081 178.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 36' ' ' LEU . 7.8 mp -69.8 -56.65 6.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.261 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.456 HG22 ' H ' ' A' ' 55' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.052 179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.5 t70 . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.726 0.298 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 105' ' ' ALA . 3.0 pp -69.03 -42.09 76.82 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.423 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.582 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.0 tp60 -50.4 -19.38 0.83 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.507 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.1 ttm180 -86.27 -32.65 20.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.398 -1.273 . . . . 0.0 110.003 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -56.47 -56.84 16.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.427 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.678 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.6 OUTLIER -77.53 -33.61 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.318 -179.217 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.59 -59.87 4.32 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.283 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.872 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.8 tp -53.83 -35.68 61.72 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.15 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.514 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.6 t -64.27 -52.62 57.71 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -48.12 -18.58 0.21 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.872 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -72.67 -53.92 10.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.817 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 112' ' ' GLU . 6.3 mm-40 -46.51 -23.08 0.33 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.471 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.88 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.758 0.313 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -59.02 -37.98 78.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.601 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -73.36 -38.16 65.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.511 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.35 -54.62 43.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.688 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.427 HG13 ' N ' ' A' ' 130' ' ' SER . 31.7 pt -59.39 -36.32 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.6 m -63.38 -74.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.502 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 130' ' ' SER . 2.3 tpp180 -33.8 -65.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.387 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 133' ' ' LEU . 79.5 t -39.48 -61.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.526 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.456 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER -35.53 -51.74 0.64 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.514 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.567 ' C ' ' H ' ' A' ' 136' ' ' SER . 48.6 mt-10 -63.55 -64.68 0.83 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.579 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.59 9.49 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.721 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.567 ' H ' ' C ' ' A' ' 134' ' ' GLU . 13.5 t . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.635 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.606 0.241 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -45.56 -58.37 3.45 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.912 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -58.92 -48.15 82.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.058 0.456 . . . . 0.0 111.312 -179.222 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.518 ' N ' ' CG2' ' A' ' 19' ' ' THR . 22.8 t80 -49.3 -59.0 4.09 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.953 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.446 HD13 ' NE2' ' A' ' 37' ' ' GLN . 21.2 mt -61.8 -39.43 91.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.029 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.666 ' OD1' ' NH2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -53.41 -40.81 65.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.926 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.647 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.6 mt-30 -59.58 -52.08 67.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.575 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.737 HD11 ' HB1' ' A' ' 50' ' ' ALA . 9.9 mt -44.35 -36.58 2.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.588 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.666 ' NH2' ' OD1' ' A' ' 22' ' ' ASN . 2.1 ttm105 -77.43 -19.26 56.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.715 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.4 tt0 -87.62 -58.59 2.52 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.576 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -60.77 -59.8 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.313 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.704 ' HB ' HG23 ' A' ' 51' ' ' VAL . 0.2 OUTLIER -85.08 -3.08 58.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.42 -178.725 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 60.66 30.81 73.23 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.214 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.488 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 17.1 mm -82.84 147.41 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 117.213 0.507 . . . . 0.0 110.56 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -104.8 -50.67 3.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.99 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -43.36 103.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.548 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 p -68.59 -25.53 64.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.14 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -64.65 -44.86 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.97 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.508 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.8 mp -67.98 -25.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.451 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -69.81 -50.18 45.52 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.877 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.446 ' NE2' HD13 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -59.46 -32.05 69.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.093 -179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -72.74 -38.18 67.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.332 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.783 ' HB2' HD21 ' A' ' 54' ' ' LEU . . . -63.98 -34.7 78.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.746 HD23 ' O ' ' A' ' 40' ' ' LEU . 3.6 tt -65.85 -44.83 84.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.162 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.9 mmtp -59.17 -34.77 72.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.74 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.512 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -86.2 -13.46 46.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.476 ' O ' ' CB ' ' A' ' 44' ' ' ASN . 14.4 m -97.13 -30.34 13.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.315 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.476 ' CB ' ' O ' ' A' ' 43' ' ' SER . 5.7 t30 77.73 24.38 0.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.134 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.12 8.68 47.0 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.438 ' HB3' HD23 ' A' ' 49' ' ' LEU . 94.9 m-20 -97.17 130.95 44.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.576 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -82.54 -63.55 1.35 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.426 -178.151 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.43 ' C ' HD22 ' A' ' 49' ' ' LEU . 2.6 tt0 -45.44 -21.5 0.1 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 49' ' ' LEU . 3.2 mm? -87.97 -45.64 10.05 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.737 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.931 HG13 ' H ' ' A' ' 52' ' ' ALA . 4.2 p -59.87 -61.13 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.931 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -46.55 -42.33 15.7 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.159 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -52.7 -28.83 23.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.81 178.692 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.783 HD21 ' HB2' ' A' ' 39' ' ' ALA . 6.2 mt -83.18 -49.19 9.72 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.48 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.445 ' H ' HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 121.047 0.451 . . . . 0.0 109.889 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.773 0.321 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.592 ' C ' ' N ' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -75.55 -53.41 8.67 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.484 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.429 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -43.91 -19.39 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.755 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.592 ' N ' ' C ' ' A' ' 102' ' ' LEU . 9.6 mtp180 -87.22 -39.21 15.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.391 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -52.88 -57.24 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.506 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -64.83 -55.35 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 CA-C-O 121.602 0.715 . . . . 0.0 110.339 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.01 -46.15 5.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.652 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -59.24 -46.52 88.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.848 180.0 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.519 ' C ' ' N ' ' A' ' 111' ' ' ALA . 6.7 t -68.43 -53.21 25.14 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.616 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 tp -47.48 -17.77 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.99 -56.96 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.576 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -46.32 -24.25 0.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.624 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.416 ' N ' ' C ' ' A' ' 111' ' ' ALA . 58.2 m . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.178 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.583 ' OE1' ' N ' ' A' ' 126' ' ' GLU . 2.4 tm-20 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.851 0.358 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.583 ' N ' ' OE1' ' A' ' 125' ' ' GLU . 20.2 tt0 -48.78 -43.04 37.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.268 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.66 -45.93 92.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.255 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.44 -59.39 4.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.377 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.5 mm -42.78 -55.65 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.781 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.05 -52.09 12.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.736 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -46.6 -48.49 19.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.93 -54.66 28.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.786 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -49.7 -44.29 48.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.68 -61.24 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -41.98 -30.13 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.492 -179.947 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.595 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 4.7 mt-30 -71.64 -25.22 62.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.316 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -71.08 -51.38 25.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.228 0.537 . . . . 0.0 110.484 -179.527 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.595 ' N ' ' CG2' ' A' ' 19' ' ' THR . 42.6 t80 -60.02 -53.92 52.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.032 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 17' ' ' GLN . 13.3 mt -59.8 -45.75 91.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.148 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.595 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 6.0 t30 -50.05 -49.7 50.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.601 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.3 mm100 -54.9 -56.05 23.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.92 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 ' HB3' ' A' ' 50' ' ' ALA . 1.1 tp -44.92 -28.79 0.71 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.319 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.59 -24.26 24.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.152 0.501 . . . . 0.0 109.939 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' A' ' 23' ' ' GLN . 62.6 tt0 -88.25 -56.67 3.22 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.54 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -52.88 -59.6 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.427 -176.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.622 HG22 HG23 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -87.2 -6.49 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.742 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.99 9.9 67.33 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.35 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.527 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 2.0 mm -59.43 153.31 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 117.666 0.733 . . . . 0.0 110.287 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.467 ' N ' HG22 ' A' ' 30' ' ' ILE . 4.4 p30 -113.47 -42.74 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.854 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.1 m-20 -44.89 101.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.557 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.9 m -67.13 -31.51 72.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.191 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.434 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.3 OUTLIER -65.02 -37.03 86.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.857 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.434 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 42.8 mm -67.24 -39.75 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.907 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.564 ' HA ' HD23 ' A' ' 24' ' ' LEU . 7.2 mt -61.19 -60.71 3.34 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.378 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -45.61 -32.87 2.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.041 0.448 . . . . 0.0 110.276 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -81.43 -30.48 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.544 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -74.87 -24.11 58.51 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.0 tm? -77.68 -42.6 34.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.009 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -62.2 -43.22 99.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.532 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 80.4 m-20 -86.19 -22.45 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.707 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -63.93 -30.96 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.629 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.5 m-20 79.88 9.26 1.47 Allowed 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.901 -0.319 . . . . 0.0 110.496 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.15 15.45 25.84 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.516 ' CB ' HD22 ' A' ' 49' ' ' LEU . 0.6 OUTLIER -104.85 131.07 52.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.637 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.54 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.96 -61.07 2.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.006 -178.832 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.417 ' C ' HG12 ' A' ' 51' ' ' VAL . 5.2 mt-10 -54.01 -25.84 23.25 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 1.179 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -88.53 -25.98 22.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.115 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 1.179 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -79.85 -54.21 6.04 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 55' ' ' THR . 11.6 p -44.11 -40.18 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.595 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -64.9 -33.64 76.5 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.425 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.634 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.7 OUTLIER -54.35 -33.1 58.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.523 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.75 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -87.59 -52.48 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.836 -179.082 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 51' ' ' VAL . 2.8 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.313 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.708 0.289 . . . . 0.0 110.851 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.603 ' C ' HD12 ' A' ' 102' ' ' LEU . 1.1 pp -65.54 -33.2 75.36 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.653 ' HA ' HD11 ' A' ' 106' ' ' ILE . 1.1 tm0? -57.69 -19.32 26.23 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -87.11 -29.22 22.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.166 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.96 -57.8 10.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.239 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.844 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -71.79 -35.31 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.712 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.844 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -57.38 -52.54 64.94 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.2 -38.87 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.557 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.473 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -70.33 -42.89 71.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.232 179.463 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.4 mp -48.55 -19.14 0.3 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.473 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.1 2.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.406 179.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -47.43 -20.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.942 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.419 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.007 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.851 0.358 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.34 -40.6 65.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.392 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -25.9 65.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -75.72 -57.48 3.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.702 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.2 mt -53.8 -45.56 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.677 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 131' ' ' ARG . 1.4 t -60.54 -64.97 0.77 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.671 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 130' ' ' SER . 5.7 mtp85 -38.54 -49.95 1.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 128' ' ' ALA . 46.6 t -58.75 -51.32 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.721 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.4 ' O ' ' OG ' ' A' ' 136' ' ' SER . 5.0 mt -43.46 -57.46 3.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.758 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLU . . . . . 0.434 ' C ' ' OE1' ' A' ' 134' ' ' GLU . 11.8 tm-20 -53.11 -57.33 10.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.586 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -50.91 -26.18 5.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 132' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.54 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.402 HE21 HD11 ' A' ' 40' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.887 0.375 . . . . 0.0 110.396 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -46.59 -41.88 15.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.364 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.425 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -68.04 -40.18 82.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.533 0.682 . . . . 0.0 109.651 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.599 ' CE1' HD22 ' A' ' 47' ' ' LEU . 10.0 t80 -57.82 -56.25 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.934 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.1 mt -64.22 -45.76 86.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.974 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.512 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 14.0 t-20 -46.45 -38.72 9.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -42.99 84.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.741 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.825 ' O ' HG22 ' A' ' 28' ' ' THR . 20.3 mt -54.45 -58.66 6.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -59.03 -18.09 31.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.278 0.561 . . . . 0.0 109.702 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -76.94 -44.73 30.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.288 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.645 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -91.38 -41.31 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.423 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.825 HG22 ' O ' ' A' ' 24' ' ' LEU . 3.8 t -95.18 -4.73 45.44 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.941 -177.283 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.52 31.52 66.99 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.41 -0.424 . . . . 0.0 112.449 178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.71 ' HB ' HD21 ' A' ' 36' ' ' LEU . 47.1 mm -90.07 112.39 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.586 -0.445 . . . . 0.0 110.056 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.494 ' O ' ' N ' ' A' ' 33' ' ' THR . 6.0 p-10 -76.66 -41.7 44.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.421 ' OD1' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -50.16 90.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.411 -179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.552 ' HA ' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -58.03 -37.09 73.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.772 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.37 -44.12 84.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.031 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.3 mm -67.88 -28.85 42.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.253 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.728 HD22 ' HB3' ' A' ' 24' ' ' LEU . 96.3 mt -69.33 -51.78 33.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.166 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -53.22 -27.29 21.16 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 7.7 mm-40 -79.39 -25.18 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.326 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.98 -40.01 32.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.246 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 1.069 HD22 ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.77 -29.7 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.019 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.859 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -69.7 -43.92 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.766 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.47 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.7 m-20 -74.55 -19.31 60.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.776 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.739 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -82.97 -30.79 27.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.928 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.739 ' ND2' ' O ' ' A' ' 43' ' ' SER . 0.0 OUTLIER 80.66 23.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.095 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.52 8.63 42.98 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.548 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.1 m120 -96.58 130.75 43.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.688 ' O ' HG12 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -83.46 -63.05 1.43 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.447 ' C ' HD22 ' A' ' 49' ' ' LEU . 21.2 tt0 -45.56 -21.82 0.12 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.698 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.8 mm? -85.87 -42.89 13.72 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.31 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.667 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -61.11 -56.74 17.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 52' ' ' ALA . 1.1 p -50.16 -65.17 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.991 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.83 -42.26 12.14 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.037 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -54.78 -31.11 58.41 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.62 ' CD1' HD22 ' A' ' 24' ' ' LEU . 3.3 mt -87.15 -50.23 6.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.293 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.791 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ASP . . . . . 0.426 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.281 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 102' ' ' LEU . 4.2 mm? -55.38 -33.77 63.73 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 120.417 -0.513 . . . . 0.0 109.658 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.684 ' HA ' HD11 ' A' ' 106' ' ' ILE . 21.3 tp60 -55.18 -19.74 8.67 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.426 ' CB ' ' O ' ' A' ' 101' ' ' ASP . 23.7 ttt180 -85.92 -32.57 21.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.354 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.68 -57.8 11.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.547 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.684 HD11 ' HA ' ' A' ' 103' ' ' GLN . 0.7 OUTLIER -74.24 -31.86 30.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 CA-C-O 121.087 0.47 . . . . 0.0 111.188 -179.118 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.15 -52.18 64.86 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.25 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.3 mp -57.83 -38.7 76.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.987 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.503 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -72.36 -54.66 8.8 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.191 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.404 ' HA ' HD22 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -47.49 -17.93 0.11 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.537 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -85.88 -47.72 9.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.301 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.05 -22.53 0.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.461 ' N ' ' C ' ' A' ' 111' ' ' ALA . 62.0 m . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.447 ' CD ' ' N ' ' A' ' 125' ' ' GLU . 1.1 pm0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -54.89 -44.77 74.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.516 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.02 -31.11 72.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.546 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -59.4 -75.67 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.397 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 130' ' ' SER . 18.9 tt -44.58 -45.67 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.319 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.579 ' N ' HG23 ' A' ' 129' ' ' ILE . 4.0 p -57.55 -40.95 79.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.28 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -47.54 63.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.195 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.555 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 21.8 t -56.16 -43.51 76.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.123 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.39 -56.52 16.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.209 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.47 -37.34 56.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.315 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.466 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.562 HG22 ' O ' ' A' ' 2' ' ' THR . 91.5 m -98.31 56.49 1.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 3' ' ' VAL . 8.9 p -49.98 126.51 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.618 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.16 40.64 0.35 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.619 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.425 ' O ' ' CB ' ' A' ' 6' ' ' ASN . 1.0 OUTLIER -158.43 -171.59 3.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.549 179.923 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 2.3 m-20 166.32 -65.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.401 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -173.76 103.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.491 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.783 HD22 ' C ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -81.22 144.83 31.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.108 0.48 . . . . 0.0 110.761 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -134.62 98.36 4.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.906 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 47.65 -143.53 0.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.719 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 m 65.55 52.75 1.31 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.379 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.94 -49.58 13.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.519 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.55 -37.83 68.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.179 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -73.62 -26.86 60.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.224 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -57.87 -18.83 25.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.457 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -59.16 2.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.957 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -58.02 -32.96 68.45 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.856 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -60.43 -54.19 48.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.539 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.623 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -62.73 -51.5 66.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.725 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.623 ' N ' ' CG2' ' A' ' 19' ' ' THR . 55.9 t80 -55.75 -53.02 61.72 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.143 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' A' ' 37' ' ' GLN . 27.9 mt -62.56 -48.45 79.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.287 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 9.9 m-20 -50.22 -43.55 52.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.246 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.4 mt-30 -56.73 -53.54 56.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.087 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 54' ' ' LEU . 11.7 mt -43.29 -35.39 1.47 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 123.336 0.397 . . . . 0.0 110.779 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -76.42 -21.41 56.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.174 0.511 . . . . 0.0 109.79 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.664 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.8 tt0 -87.36 -58.49 2.56 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.537 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -59.18 -59.6 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.431 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.6 OUTLIER -82.65 -2.84 55.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 -178.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.42 25.02 59.99 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.768 HG22 ' H ' ' A' ' 32' ' ' ASP . 3.3 mm -69.28 159.78 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.131 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.474 ' N ' HG22 ' A' ' 30' ' ' ILE . 17.2 m-20 -132.36 22.25 4.39 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.283 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.768 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -103.85 121.19 42.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.611 ' O ' ' NE2' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -82.07 -26.48 33.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.249 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.538 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 8.1 mm100 -83.96 -46.75 11.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 0.0 111.151 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 35' ' ' ILE . 6.3 mm -66.8 -20.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.081 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -74.12 -63.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.064 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.611 ' NE2' ' O ' ' A' ' 33' ' ' THR . 3.6 pt20 -50.86 -25.0 3.98 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -75.47 -38.99 59.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.388 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.408 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -65.34 -19.15 65.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.895 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.485 HD13 ' CE2' ' A' ' 20' ' ' PHE . 12.2 tp -79.14 -52.99 7.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.603 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -51.81 -33.77 37.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -27.77 27.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.59 ' OG ' ' N ' ' A' ' 50' ' ' ALA . 3.6 m -80.51 -30.65 37.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.815 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.92 35.05 16.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.289 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.33 4.63 50.04 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.681 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.425 ' ND2' ' O ' ' A' ' 43' ' ' SER . 6.6 m-80 -93.8 130.96 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -84.76 -62.62 1.5 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.71 -178.013 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -52.75 -21.87 4.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.025 0.441 . . . . 0.0 110.289 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -81.49 -54.85 5.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.199 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.59 ' N ' ' OG ' ' A' ' 43' ' ' SER . . . -52.44 -36.75 55.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.479 ' O ' HG22 ' A' ' 55' ' ' THR . 1.0 OUTLIER -63.26 -49.53 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.34 177.697 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.758 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -57.0 -44.13 82.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.785 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -60.55 -24.56 65.48 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.863 -0.735 . . . . 0.0 110.816 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.575 ' CD1' HD22 ' A' ' 24' ' ' LEU . 68.6 mt -87.37 -53.57 4.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.744 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 57' ' ' LYS . 12.9 t -91.06 -38.45 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.758 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 35.12 20.54 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.249 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.689 ' N ' ' O ' ' A' ' 55' ' ' THR . 13.1 mtpp -137.19 -100.42 0.2 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.009 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.753 ' O ' ' HB2' ' A' ' 59' ' ' ALA . 78.1 m-20 -108.73 -164.16 0.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.87 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.753 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 156.61 138.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG3' ' N ' ' A' ' 61' ' ' THR . 2.4 ptpt -121.31 -123.64 0.28 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.402 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.829 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 9.0 m -162.13 -37.33 0.0 OUTLIER Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.79 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.829 ' CD ' ' H ' ' A' ' 61' ' ' THR . 12.5 Cg_endo -88.29 16.01 1.97 Allowed 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.895 2.396 . . . . 0.0 111.871 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -57.91 -84.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.685 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.435 ' O ' ' CD ' ' A' ' 64' ' ' GLN . 1.2 tm0? -124.15 100.79 6.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.42 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 67' ' ' THR . 4.9 tp10 -68.15 120.29 14.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.624 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 65' ' ' GLU . 6.4 tt0 -37.14 93.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -98.24 -46.88 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.989 -179.705 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.432 ' OG1' ' N ' ' A' ' 69' ' ' TYR . 4.2 t -160.71 -179.16 7.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.96 0.409 . . . . 0.0 111.008 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 1.6 p90 -157.25 70.18 0.6 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.227 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -148.12 -85.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.649 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -96.46 35.02 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.595 ' O ' ' N ' ' A' ' 74' ' ' LEU . 4.4 m 44.23 17.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.545 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.513 ' O ' ' C ' ' A' ' 74' ' ' LEU . . . 42.26 15.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.46 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' THR . 7.9 tp -28.35 93.75 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.511 ' N ' ' O ' ' A' ' 73' ' ' ALA . 74.4 Cg_endo -80.71 16.43 1.59 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.611 2.207 . . . . 0.0 112.008 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 165.51 150.07 6.11 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.603 ' O ' ' CB ' ' A' ' 78' ' ' ASP . 0.0 OUTLIER -100.21 -88.09 0.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.78 0.324 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.603 ' CB ' ' O ' ' A' ' 77' ' ' ASN . 0.1 OUTLIER 152.99 157.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.403 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -66.1 125.8 26.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.24 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.564 ' O ' ' C ' ' A' ' 81' ' ' ILE . 0.8 OUTLIER -82.48 -169.9 2.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.303 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.564 ' C ' ' O ' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -22.51 -84.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.867 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.78 -170.14 0.86 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 83' ' ' VAL . 0.1 OUTLIER -72.7 179.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.605 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -77.34 -51.78 5.93 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 67.48 70.2 0.36 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -73.89 174.02 9.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.654 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.13 141.91 49.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.352 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.6 30.5 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.66 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 p -65.59 121.98 16.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -171.25 26.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.013 0.435 . . . . 0.0 110.047 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.612 ' O ' ' O ' ' A' ' 92' ' ' ILE . 14.0 m -99.89 -116.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.039 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.678 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.6 tt 31.33 -161.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.678 ' N ' HG23 ' A' ' 92' ' ' ILE . 15.1 m-20 -152.42 134.91 15.23 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.076 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.5 mp -75.84 -36.52 59.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -47.08 6.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.699 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.427 ' O ' ' C ' ' A' ' 97' ' ' ASP . . . 79.34 13.02 83.25 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.427 ' C ' ' O ' ' A' ' 96' ' ' GLY . 0.1 OUTLIER 37.85 79.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 0.0 110.584 -179.894 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.77 81.5 1.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.431 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -92.94 -1.48 56.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.783 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.65 -15.62 63.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.761 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.448 ' N ' ' OD1' ' A' ' 101' ' ' ASP . 1.0 OUTLIER -51.17 -55.61 17.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.075 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.831 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -56.12 -35.65 67.32 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.581 -179.382 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.455 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 2.1 tt0 -53.91 -19.51 4.66 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.441 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.1 ttt180 -86.54 -33.05 20.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.857 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.55 -53.97 49.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.159 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.476 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.68 -47.33 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.352 0.596 . . . . 0.0 110.573 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.82 -57.34 7.56 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.158 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -46.59 -44.75 18.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.102 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.467 ' C ' ' N ' ' A' ' 111' ' ' ALA . 8.7 t -63.87 -44.43 93.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.218 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -48.61 -19.02 0.3 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.45 -57.99 2.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.65 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -47.77 -18.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.307 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.581 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -90.27 -54.47 4.0 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.627 179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -62.19 3.46 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.102 0.477 . . . . 0.0 109.755 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.581 ' H ' ' C ' ' A' ' 113' ' ' SER . 3.0 mpt_? -118.59 -27.87 5.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.678 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -86.54 -18.52 31.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.905 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.27 174.26 7.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.256 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.637 ' C ' ' H ' ' A' ' 120' ' ' THR . 7.2 mtp85 -127.23 23.77 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.873 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 64.23 -32.99 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.637 ' H ' ' C ' ' A' ' 118' ' ' ARG . 28.1 p -70.57 -109.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.17 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLY . . . . . 0.577 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 119.72 -35.45 3.83 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.706 HD13 ' N ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -73.67 -16.15 17.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.782 0.325 . . . . 0.0 110.65 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 122' ' ' ILE . 17.0 p 56.02 60.54 3.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.699 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -79.03 3.22 17.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.567 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.416 ' H ' ' HG3' ' A' ' 125' ' ' GLU . 1.9 pp20? -59.98 -39.93 87.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.694 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' A' ' 125' ' ' GLU . 1.8 tt0 -55.42 -53.26 58.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.862 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.51 -27.67 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.632 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 130' ' ' SER . . . -72.91 -84.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.619 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.544 ' C ' ' O ' ' A' ' 128' ' ' ALA . 2.6 mt -26.9 -39.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.77 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.59 ' N ' ' O ' ' A' ' 128' ' ' ALA . 9.1 m -62.43 -68.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.645 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -43.49 -25.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.677 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 41.7 t -75.42 -62.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.643 ' O ' ' N ' ' A' ' 138' ' ' ALA . 14.5 mt -37.55 -56.18 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.76 ' O ' ' N ' ' A' ' 137' ' ' ILE . 39.9 tt0 -56.09 -41.21 74.83 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.875 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -36.4 -61.0 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.857 ' O ' HG22 ' A' ' 137' ' ' ILE . 0.0 OUTLIER -74.59 -7.75 54.13 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.892 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.857 HG22 ' O ' ' A' ' 136' ' ' SER . 7.5 tt 102.53 40.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.952 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . 15.77 -91.84 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.233 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.407 ' O ' ' O ' ' A' ' 137' ' ' ILE . 15.4 tt0 -67.88 -144.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -157.61 135.7 10.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.605 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -87.7 -83.0 0.21 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.408 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.06 90.91 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.528 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.424 ' C ' HD22 ' A' ' 144' ' ' LEU . 27.8 p -46.38 154.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.758 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.754 HD22 ' N ' ' A' ' 144' ' ' LEU . 3.3 mm? -92.59 -159.74 0.69 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.435 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -75.44 -10.47 59.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.544 -179.911 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 3' ' ' VAL . 2.7 mtt . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.595 ' O ' ' O ' ' A' ' 3' ' ' VAL . 17.4 m -56.99 80.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.412 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 2' ' ' THR . 48.4 t -42.31 -107.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.701 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.682 ' O ' ' N ' ' A' ' 6' ' ' ASN . 32.1 mm-40 -93.49 -77.97 0.44 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.372 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.593 ' O ' ' CB ' ' A' ' 6' ' ' ASN . 0.6 OUTLIER 47.79 -79.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.64 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.682 ' N ' ' O ' ' A' ' 4' ' ' GLU . 1.6 t-20 88.88 -174.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.336 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.02 143.94 30.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.546 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.66 102.34 4.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.059 0.457 . . . . 0.0 110.448 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.488 ' HG3' ' H ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -50.81 -179.78 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.474 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.558 ' CG ' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -123.55 -129.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.604 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.558 ' H ' ' CG ' ' A' ' 10' ' ' GLN . 77.6 p -125.82 -97.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.413 ' N ' ' OG ' ' A' ' 11' ' ' SER . . . -47.8 -16.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.731 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.439 ' N ' ' C ' ' A' ' 11' ' ' SER . . . -79.24 -25.89 42.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.529 ' CG ' ' N ' ' A' ' 15' ' ' LYS . 8.2 pt20 -84.34 -43.48 14.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.754 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.529 ' N ' ' CG ' ' A' ' 14' ' ' GLN . 10.0 ptmm? -59.77 -27.26 66.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.954 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -79.7 -50.12 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.769 0.319 . . . . 0.0 110.941 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -52.89 -40.98 63.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.936 0.398 . . . . 0.0 110.749 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -60.21 -43.34 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.12 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.462 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -81.03 -42.06 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.215 0.531 . . . . 0.0 110.853 -179.592 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.462 ' N ' ' CG2' ' A' ' 19' ' ' THR . 29.4 t80 -56.84 -56.86 16.17 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.564 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.0 mt -64.46 -39.91 94.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.105 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.62 -40.73 75.87 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.07 -47.5 80.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.056 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.541 HD11 ' HB1' ' A' ' 50' ' ' ALA . 14.7 mt -51.16 -53.57 33.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.179 0.514 . . . . 0.0 110.644 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.668 ' C ' ' HE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -60.07 -16.57 32.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.26 0.553 . . . . 0.0 109.593 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -82.08 -57.47 3.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.542 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -78.27 -46.81 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.365 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.542 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.0 t -92.35 -3.17 55.75 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.665 -177.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.57 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . 62.72 -7.6 0.25 Allowed Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.708 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.537 HG13 HD23 ' A' ' 54' ' ' LEU . 41.1 mm -59.17 97.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 117.911 0.856 . . . . 0.0 110.301 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 29' ' ' GLY . 3.8 m-20 -83.06 36.56 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.134 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -106.91 85.56 2.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.9 0.381 . . . . 0.0 110.114 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -43.7 -37.05 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.019 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -47.22 83.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.656 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.7 mp -75.62 -33.08 25.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.657 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.548 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.8 mt -65.35 -63.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -51.3 -28.13 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.097 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -78.21 -39.43 40.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.84 82.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.048 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.2 tm? -67.93 -43.05 80.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.79 -40.26 20.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.577 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.5 t0 -87.3 -40.19 14.7 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.602 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -63.87 -24.29 67.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.465 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.682 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 1.4 p-10 50.35 42.15 25.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.558 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.64 -1.39 49.13 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.063 178.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.602 ' O ' ' OG ' ' A' ' 43' ' ' SER . 5.0 m-20 -96.85 122.8 40.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 50' ' ' ALA . 21.6 tp -84.99 -61.79 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.248 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.539 ' C ' HD22 ' A' ' 49' ' ' LEU . 5.3 mt-10 -42.73 -21.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.774 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -89.61 -39.3 13.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.618 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -67.38 -54.83 17.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.755 HG13 ' N ' ' A' ' 52' ' ' ALA . 10.1 p -53.46 -53.16 26.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.755 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.54 -45.02 66.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.455 -1.248 . . . . 0.0 109.586 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -49.18 -27.81 3.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.636 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.2 mp -85.86 -52.42 5.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.737 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.515 ' O ' ' C ' ' A' ' 56' ' ' ALA . 2.6 t -82.27 -45.58 14.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.479 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.689 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -31.25 144.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.363 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.407 ' C ' ' OD1' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.913 0.387 . . . . 0.0 110.635 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.508 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 0.1 OUTLIER -168.9 41.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.154 179.752 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 70.51 -146.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.407 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.426 ' HE2' ' H ' ' A' ' 61' ' ' THR . 8.8 ttpt -88.0 -137.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.434 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.434 ' N ' ' HD3' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -148.47 64.32 7.81 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.41 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 61' ' ' THR . 73.0 Cg_endo -84.27 -101.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.302 -1.88 0 C-N-CA 123.267 2.645 . . . . 0.0 112.163 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.534 ' CD ' ' O ' ' A' ' 63' ' ' GLN . 16.1 tm0? 50.15 64.28 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.621 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 51.03 89.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.525 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -97.34 5.61 49.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.68 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -80.2 -96.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.742 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.418 ' O ' ' OG1' ' A' ' 68' ' ' THR . 21.7 m -40.93 101.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.69 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.956 HG22 ' H ' ' A' ' 69' ' ' TYR . 27.8 m -166.93 -176.68 3.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.306 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.956 ' H ' HG22 ' A' ' 68' ' ' THR . 9.0 p90 -150.64 133.38 15.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.543 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -108.91 -172.4 2.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.328 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -120.73 -6.44 9.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.299 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.6 m -87.2 102.39 14.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.364 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -171.4 122.85 0.55 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.77 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 56.7 tp -90.11 -27.28 0.32 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.495 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.77 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 39.3 Cg_exo -57.24 55.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.529 2.153 . . . . 0.0 112.12 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.671 ' N ' ' O ' ' A' ' 74' ' ' LEU . . . -117.49 83.31 0.34 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -157.06 139.13 14.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.838 0.351 . . . . 0.0 110.541 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 80' ' ' TYR . 0.3 OUTLIER -122.84 -169.2 1.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.545 179.831 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.3 -88.16 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.577 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 78' ' ' ASP . 8.2 m-85 71.32 160.01 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.974 0.416 . . . . 0.0 110.541 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 20.5 mt 70.65 119.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.478 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 172.18 -25.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.709 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.0 144.5 25.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.648 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.436 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . -115.01 -92.63 1.86 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.541 ' O ' ' O ' ' A' ' 86' ' ' GLN . 0.3 OUTLIER 165.66 65.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.844 0.354 . . . . 0.0 110.69 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.541 ' O ' ' O ' ' A' ' 85' ' ' SER . 1.8 mt-30 33.96 -157.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.44 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 89' ' ' THR . . . -141.3 150.44 42.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.537 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.525 ' O ' ' OG1' ' A' ' 89' ' ' THR . 5.7 p-10 -57.33 -22.35 41.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.315 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.709 ' O ' ' ND2' ' A' ' 90' ' ' ASN . 77.7 p 53.55 175.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.528 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.709 ' ND2' ' O ' ' A' ' 89' ' ' THR . 1.5 m-80 -171.06 37.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.174 0.512 . . . . 0.0 110.002 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 92' ' ' ILE . 2.0 m -115.01 -104.02 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.94 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.848 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.4 OUTLIER 30.61 -157.28 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.179 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.848 ' N ' HG23 ' A' ' 92' ' ' ILE . 0.9 OUTLIER 61.64 101.03 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.494 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.92 29.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.795 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.08 -27.11 2.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.418 ' O ' ' C ' ' A' ' 97' ' ' ASP . . . -69.48 -25.31 75.62 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -38.3 -59.13 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.819 0.342 . . . . 0.0 110.427 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.41 144.32 42.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.307 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.489 ' CG ' ' N ' ' A' ' 100' ' ' ASP . 0.4 OUTLIER -87.84 -49.76 6.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.528 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.489 ' N ' ' CG ' ' A' ' 99' ' ' LYS . 38.4 t0 -53.37 -21.35 5.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.396 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -47.13 81.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.668 HD22 ' H ' ' A' ' 102' ' ' LEU . 2.4 mm? -73.02 -46.43 52.1 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.118 0.485 . . . . 0.0 109.84 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 20.6 tp60 -44.99 -20.11 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.538 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.2 ttt-85 -85.69 -45.79 11.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.116 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -53.97 -47.42 71.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.87 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.2 mm -62.28 -57.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 121.668 0.747 . . . . 0.0 109.924 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -45.31 -44.02 11.2 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.055 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.31 -39.23 66.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.148 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.464 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.7 OUTLIER -73.49 -46.73 46.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.238 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 110' ' ' LEU . 1.6 mm? -48.39 -17.89 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.464 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -87.99 -58.41 2.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.572 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -47.58 -24.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.557 ' O ' ' N ' ' A' ' 115' ' ' ARG . 46.6 t -87.5 -47.01 9.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.929 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -45.56 -14.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.557 ' N ' ' O ' ' A' ' 113' ' ' SER . 1.7 mpt_? -102.83 -37.17 7.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.589 179.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -96.61 29.08 3.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.545 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.491 ' O ' ' N ' ' A' ' 119' ' ' GLU . 52.1 t80 -102.38 -40.8 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.718 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -33.18 -36.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.623 -179.854 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.547 ' C ' ' O ' ' A' ' 118' ' ' ARG . 3.0 tt0 27.88 56.67 0.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.554 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 t -54.71 139.45 39.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.676 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -148.76 82.66 0.19 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 2.1 tt -119.11 148.65 21.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.775 0.321 . . . . 0.0 110.521 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 81.4 p -60.02 152.98 22.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.492 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -134.89 5.13 3.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.508 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -76.03 -29.59 58.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.492 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.4 -49.65 76.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.631 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.42 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.1 OUTLIER -67.78 -30.33 69.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.521 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.48 73.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.541 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.8 mt -59.76 -58.21 8.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.587 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.91 -37.94 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.497 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.66 -56.65 18.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.533 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 132' ' ' VAL . 4.1 t -44.38 -36.01 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.52 ' O ' ' C ' ' A' ' 134' ' ' GLU . 2.4 mp -67.69 -89.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.966 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.693 ' O ' ' N ' ' A' ' 137' ' ' ILE . 31.4 mt-10 -33.58 -49.72 0.31 Allowed 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.592 ' C ' ' H ' ' A' ' 137' ' ' ILE . . . -37.44 -69.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.738 ' C ' HG23 ' A' ' 137' ' ' ILE . 0.1 OUTLIER -68.61 11.21 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.738 HG23 ' C ' ' A' ' 136' ' ' SER . 0.0 OUTLIER 74.57 43.98 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.41 -179.502 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.61 ' C ' ' O ' ' A' ' 137' ' ' ILE . . . 1.12 -68.15 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.588 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.641 ' N ' ' O ' ' A' ' 137' ' ' ILE . 10.3 mm-40 -87.63 139.34 30.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.939 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.601 ' N ' ' OD1' ' A' ' 140' ' ' ASN . 3.0 p-10 -131.89 51.64 2.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.525 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -70.72 -117.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.515 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 144' ' ' LEU . . . 40.74 -155.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.551 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 42.8 t 58.82 -85.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.643 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.467 ' HA ' HD13 ' A' ' 144' ' ' LEU . 0.7 OUTLIER -58.5 116.21 3.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.426 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -161.71 0.59 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.635 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.674 179.935 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.8 mmt . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.59 ' O ' ' O ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -75.49 167.18 22.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.404 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.59 ' O ' ' O ' ' A' ' 2' ' ' THR . 39.7 t -37.22 -105.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.479 ' N ' HG12 ' A' ' 3' ' ' VAL . 10.4 tt0 -132.72 60.87 1.69 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.592 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -117.51 149.9 39.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.698 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.604 ' O ' ' O ' ' A' ' 7' ' ' VAL . 63.5 m-20 54.11 40.34 31.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.941 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.604 ' O ' ' O ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 21.04 104.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.142 179.839 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.942 ' H ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -104.56 2.1 30.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.985 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.648 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.6 tt0 -84.27 131.8 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.729 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.602 ' O ' ' C ' ' A' ' 11' ' ' SER . 1.3 tp60 64.55 -12.86 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.799 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.602 ' C ' ' O ' ' A' ' 10' ' ' GLN . 5.3 p 9.41 80.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.474 0.484 . . . . 0.0 111.534 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.16 -17.6 63.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.547 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.32 2.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.559 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -18.57 1.02 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.391 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -54.43 -35.8 63.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.672 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -75.83 -58.29 3.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.655 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -52.5 -32.26 39.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.873 0.368 . . . . 0.0 110.425 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -59.89 -55.09 38.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.622 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.601 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -68.51 -48.36 64.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.297 0.57 . . . . 0.0 110.313 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.601 ' N ' ' CG2' ' A' ' 19' ' ' THR . 40.0 t80 -47.35 -60.28 2.61 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.972 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.86 -52.07 65.64 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.956 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -45.14 -32.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.692 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -71.87 -48.8 43.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.882 179.191 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.057 HD21 ' HB1' ' A' ' 50' ' ' ALA . 1.9 mp -45.24 -25.67 0.4 Allowed 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.426 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -88.38 -24.39 23.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.766 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.692 ' N ' ' O ' ' A' ' 23' ' ' GLN . 5.6 tm-20 -86.84 -57.77 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.35 -59.68 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.113 -177.492 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.5 -5.14 58.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.787 -179.186 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.35 32.65 76.01 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.209 -0.519 . . . . 0.0 111.893 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.407 HG22 ' N ' ' A' ' 31' ' ' ASN . 3.1 mm -88.25 153.58 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.66 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.589 ' N ' ' OD1' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -108.08 -54.57 2.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.907 -179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.618 ' HB2' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -41.24 101.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.353 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.3 m -66.7 -24.81 66.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.164 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -69.04 -51.71 36.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.756 0.312 . . . . 0.0 110.857 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.618 HD12 ' HB2' ' A' ' 32' ' ' ASP . 69.8 mt -53.21 -20.59 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.603 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -80.18 -60.66 2.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.725 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -43.38 -25.2 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.574 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 1.5 tt0 -79.22 -39.87 32.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.004 179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -63.18 -36.4 83.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.817 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.79 HD23 ' O ' ' A' ' 40' ' ' LEU . 7.0 tt -66.57 -40.45 88.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.005 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -52.83 -39.19 62.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.024 0.44 . . . . 0.0 109.891 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.4 m-20 -86.76 -30.0 21.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.502 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 0.1 OUTLIER -79.38 -21.47 45.68 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.083 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 40' ' ' LEU . 36.3 m120 62.21 29.85 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.939 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.45 1.42 53.53 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.502 ' N ' ' OG ' ' A' ' 43' ' ' SER . 5.2 m-20 -88.07 130.65 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.257 . . . . 0.0 110.378 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.478 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -83.98 -63.39 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.242 -178.681 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.562 ' C ' HD22 ' A' ' 49' ' ' LEU . 11.9 mt-10 -45.66 -22.4 0.17 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.42 0.629 . . . . 0.0 109.533 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.799 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -89.71 -41.17 12.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.316 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 1.057 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -63.23 -46.89 84.8 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.803 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.9 p -58.75 -59.12 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.803 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -50.07 -40.19 44.63 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.458 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -53.93 -32.84 54.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.161 179.096 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.568 HD12 ' O ' ' A' ' 50' ' ' ALA . 5.4 mp -85.76 -51.95 6.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.354 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 51' ' ' VAL . 0.1 OUTLIER -71.74 -50.53 29.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.112 179.834 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.684 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 7.17 -102.83 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.697 0.623 . . . . 0.0 110.922 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.55 ' O ' ' CG ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -75.35 140.79 43.27 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.55 ' CG ' ' O ' ' A' ' 57' ' ' LYS . 13.4 p30 47.0 -160.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 176.85 47.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.019 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.567 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.0 OUTLIER -157.97 143.15 16.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.388 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.7 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -174.44 -39.97 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.443 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.7 ' CD ' ' H ' ' A' ' 61' ' ' THR . 14.5 Cg_exo -66.32 -22.62 52.71 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.619 2.213 . . . . 0.0 112.23 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 64' ' ' GLN . 0.0 OUTLIER -65.62 127.77 33.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.66 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 63' ' ' GLN . 5.6 tt0 38.6 58.05 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.569 ' OE1' ' O ' ' A' ' 65' ' ' GLU . 0.4 OUTLIER -86.74 -9.42 55.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.427 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.471 ' C ' ' O ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -34.7 120.64 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.357 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.41 ' O ' ' C ' ' A' ' 68' ' ' THR . 0.1 OUTLIER -143.53 -30.95 0.49 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.683 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.41 ' C ' ' O ' ' A' ' 67' ' ' THR . 4.6 m 40.17 77.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.374 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -179.26 74.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.521 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -146.4 -176.03 5.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.52 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -92.16 -108.98 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.401 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.572 ' O ' ' O ' ' A' ' 73' ' ' ALA . 40.8 p -131.7 -4.14 3.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.762 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.579 ' O ' ' O ' ' A' ' 74' ' ' LEU . . . 55.46 143.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.228 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.617 ' C ' ' H ' ' A' ' 76' ' ' GLY . 4.2 tp 31.37 98.9 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.417 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -47.65 -2.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.464 2.11 . . . . 0.0 111.825 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.617 ' H ' ' C ' ' A' ' 74' ' ' LEU . . . 72.5 126.53 0.09 OUTLIER Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 78' ' ' ASP . 13.1 t-20 -140.98 18.13 2.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.733 0.301 . . . . 0.0 110.525 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.448 ' C ' ' O ' ' A' ' 77' ' ' ASN . 0.7 OUTLIER -35.95 151.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.433 179.855 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' A' ' 79' ' ' ARG . 14.4 mtp180 -45.95 141.17 3.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.606 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.496 ' O ' ' N ' ' A' ' 82' ' ' SER . 0.2 OUTLIER -122.41 178.32 5.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.025 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt 65.49 -59.27 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 80' ' ' TYR . 1.2 p 43.88 -155.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.449 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.475 ' N ' ' OG ' ' A' ' 82' ' ' SER . 13.9 m -149.6 141.28 17.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.718 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -137.13 -97.55 0.47 Allowed Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 43.71 64.41 1.27 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 110.561 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.22 -36.08 8.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.435 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.9 137.19 1.84 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.599 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.75 89.36 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.497 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.16 114.43 16.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -161.42 28.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.355 0.598 . . . . 0.0 109.4 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.06 166.76 15.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.922 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.802 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.1 tt 179.7 -159.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.802 ' N ' HG23 ' A' ' 92' ' ' ILE . 6.0 m-20 -151.44 -80.02 0.11 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.498 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER 68.69 -45.74 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.459 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.64 ' O ' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -87.35 -34.52 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.502 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' C ' ' O ' ' A' ' 95' ' ' THR . . . 35.42 23.41 0.01 OUTLIER Glycine 0 CA--C 1.526 0.725 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.64 ' N ' ' O ' ' A' ' 95' ' ' THR . 21.7 m-20 60.76 170.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.766 0.317 . . . . 0.0 110.619 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.11 125.64 47.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.488 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 mmtp -89.27 -10.48 46.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -50.74 -32.35 19.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.438 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -51.26 -46.58 62.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.201 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.4 tt -71.86 -54.46 10.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.209 0.528 . . . . 0.0 110.292 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.411 ' N ' HD23 ' A' ' 102' ' ' LEU . 26.4 tp60 -43.96 -17.96 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 178.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.599 ' N ' ' C ' ' A' ' 102' ' ' LEU . 3.6 tpt180 -86.69 -37.72 17.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.372 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -59.93 -38.75 83.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.206 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.483 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -75.06 -37.25 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.555 0.693 . . . . 0.0 110.023 179.536 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -56.87 14.09 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.123 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 12.2 tp -48.48 -53.94 16.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.116 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 105' ' ' ALA . 0.7 OUTLIER -57.69 -49.28 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.833 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.7 mt -48.32 -17.93 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.33 -54.55 5.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.612 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.481 ' CD ' ' N ' ' A' ' 112' ' ' GLU . 0.3 OUTLIER -46.6 -23.13 0.35 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.586 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.5 OUTLIER -90.43 -54.52 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.903 179.31 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.6 -8.42 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.586 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.9 mpt_? -101.54 -52.22 3.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.872 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -54.13 -31.31 51.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.874 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -49.28 -75.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.477 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 118' ' ' ARG . 5.3 ptm180 -76.6 79.35 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.45 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.699 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -79.24 -8.99 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.432 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.7 OUTLIER -50.51 124.67 11.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.601 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -152.8 118.84 0.91 Allowed Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 87.4 mt -121.9 135.06 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 0.0 110.5 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.585 ' O ' ' N ' ' A' ' 125' ' ' GLU . 55.4 m -120.06 -101.1 0.43 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.55 ' C ' ' O ' ' A' ' 123' ' ' THR . 0.0 OUTLIER 25.89 41.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.585 ' N ' ' O ' ' A' ' 123' ' ' THR . 2.3 mm-40 -86.12 -49.18 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.681 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -58.31 -36.58 73.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -77.55 -51.02 11.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.748 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.83 -44.36 39.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.553 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.41 -62.1 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.508 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.27 -16.84 9.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.813 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.1 ttt-85 -76.03 -52.15 10.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.615 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 48.3 t -64.55 -52.93 48.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.406 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 133' ' ' LEU . 0.9 OUTLIER -47.69 -52.88 16.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.572 179.902 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -51.64 -52.1 50.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.402 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.37 -13.07 2.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.415 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.4 -3.28 15.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.462 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 2.0 tt -96.96 -10.98 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.62 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -91.56 172.99 8.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.501 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 140' ' ' ASN . 0.5 OUTLIER -79.59 126.9 31.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.715 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER -55.91 -159.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.63 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.17 -171.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.749 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -102.24 129.27 48.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.6 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 42.0 t -44.71 -75.74 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.437 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.561 ' O ' ' O ' ' A' ' 145' ' ' LYS . 0.3 OUTLIER -122.62 149.84 43.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.561 ' O ' ' O ' ' A' ' 144' ' ' LEU . 2.6 mtpt 37.85 -166.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.705 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.521 -179.976 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.0 ttt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.561 ' O ' ' C ' ' A' ' 3' ' ' VAL . 0.6 OUTLIER -79.7 -57.01 3.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.772 ' O ' HG13 ' A' ' 3' ' ' VAL . 13.5 p 21.48 82.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' OE1' ' OG1' ' A' ' 2' ' ' THR . 4.6 mp0 -84.83 27.01 0.78 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.386 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.565 ' O ' HD21 ' A' ' 8' ' ' LEU . 3.5 tt0 -112.8 88.38 2.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.606 ' C ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -65.28 -164.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.653 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.606 HG23 ' C ' ' A' ' 6' ' ' ASN . 2.5 t 76.76 -0.75 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.955 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.639 HD12 ' N ' ' A' ' 9' ' ' GLN . 0.4 OUTLIER -113.13 -7.77 13.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.957 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.639 ' N ' HD12 ' A' ' 8' ' ' LEU . 1.5 tp-100 -111.32 57.77 0.62 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.875 0.369 . . . . 0.0 110.539 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -168.41 84.46 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.588 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -76.36 -1.12 25.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.15 -41.66 27.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.696 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -47.18 -25.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.697 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -76.54 -41.76 45.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.651 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -82.32 -19.01 40.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.796 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -63.43 -23.57 67.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.994 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -45.64 -22.05 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.422 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -55.36 -44.98 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.53 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.528 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -69.25 -43.5 73.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.644 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 40' ' ' LEU . 38.3 t80 -50.96 -58.15 6.76 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.431 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.47 -42.27 96.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.004 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.59 -41.29 41.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.528 ' OE1' ' O ' ' A' ' 19' ' ' THR . 0.8 OUTLIER -60.31 -46.54 89.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.095 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 28' ' ' THR . 40.9 mt -50.35 -57.95 6.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 109.927 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.429 ' CG ' ' O ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.07 -17.31 38.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.209 0.528 . . . . 0.0 109.752 179.333 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.421 ' OE2' HG23 ' A' ' 72' ' ' THR . 23.0 tt0 -78.86 -48.77 14.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.714 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.57 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -89.86 -46.92 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.162 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 24' ' ' LEU . 2.8 t -87.39 -2.84 58.9 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.373 -177.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.06 32.44 71.07 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.698 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.598 ' HB ' HD21 ' A' ' 36' ' ' LEU . 40.3 mm -89.77 128.65 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.281 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -94.03 -47.94 6.46 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.304 -179.244 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -41.07 98.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.576 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -77.11 -39.95 47.63 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.732 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.47 HG22 ' CD2' ' A' ' 54' ' ' LEU . 34.2 mm -72.46 -21.26 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 24' ' ' LEU . 87.8 mt -76.0 -63.51 1.3 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.271 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.04 -26.0 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -73.53 -37.45 65.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.632 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.585 ' O ' ' OD1' ' A' ' 42' ' ' ASP . . . -60.37 -42.6 96.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.732 179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.053 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.68 -36.06 79.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.379 179.575 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -53.44 -41.15 65.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.025 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.7 ' OD1' ' CD2' ' A' ' 53' ' ' PHE . 7.1 p30 -87.25 -23.96 24.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.478 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.583 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.4 OUTLIER -77.52 -7.52 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.686 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.692 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 56.77 25.22 9.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.214 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.43 ' HA2' HD13 ' A' ' 40' ' ' LEU . . . 102.45 -5.87 52.3 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.58 ' O ' ' OG ' ' A' ' 43' ' ' SER . 87.8 m-20 -84.39 131.6 34.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 49' ' ' LEU . 13.2 tp -83.25 -64.11 1.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.52 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.458 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.1 tt0 -42.34 -21.02 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.691 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -88.0 -45.84 9.86 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.844 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.626 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -55.2 -53.06 60.83 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.928 HG13 ' H ' ' A' ' 52' ' ' ALA . 3.9 p -57.19 -62.86 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.558 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.928 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.24 -35.22 3.22 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.242 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.7 ' CD2' ' OD1' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -64.35 -30.37 71.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.141 179.027 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 24' ' ' LEU . 9.3 mt -87.87 -43.83 11.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.387 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.624 ' O ' ' N ' ' A' ' 57' ' ' LYS . 10.2 t -87.27 -29.79 21.38 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.004 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.886 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . -20.48 -46.74 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.952 0.406 . . . . 0.0 110.859 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -102.85 135.8 43.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.5 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -171.97 -170.16 0.73 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.469 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -156.12 -123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.653 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -103.35 169.71 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.659 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m -164.82 69.83 1.43 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.491 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.637 ' O ' ' N ' ' A' ' 64' ' ' GLN . 72.3 Cg_endo -89.36 -8.94 4.43 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 123.219 2.613 . . . . 0.0 112.096 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -45.95 -6.77 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.649 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 62' ' ' PRO . 33.2 mt-30 59.46 67.55 0.88 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.511 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.575 ' O ' ' O ' ' A' ' 66' ' ' GLU . 11.7 tt0 -103.78 -83.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.575 ' O ' ' O ' ' A' ' 65' ' ' GLU . 0.5 OUTLIER 53.59 150.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.579 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.81 0.86 2.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.567 ' OG1' ' O ' ' A' ' 68' ' ' THR . 1.5 p 56.0 75.84 0.31 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.556 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.54 ' N ' ' CD1' ' A' ' 69' ' ' TYR . 4.4 p90 -138.43 99.34 3.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.695 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.577 ' O ' ' N ' ' A' ' 72' ' ' THR . 4.0 m-85 -131.7 -65.81 0.74 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.554 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.517 ' C ' ' O ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -30.34 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.604 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.577 ' N ' ' O ' ' A' ' 70' ' ' TYR . 1.6 m -83.91 -59.64 2.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.176 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.57 ' O ' ' O ' ' A' ' 72' ' ' THR . . . 45.13 109.54 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.853 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -131.43 48.42 3.67 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.666 179.906 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.548 ' O ' ' O ' ' A' ' 76' ' ' GLY . 37.1 Cg_endo -69.88 -18.93 36.17 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.561 2.174 . . . . 0.0 111.836 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.548 ' O ' ' O ' ' A' ' 75' ' ' PRO . . . 25.84 -145.64 0.01 OUTLIER Glycine 0 CA--C 1.523 0.593 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -139.53 116.3 10.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 110.584 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.408 ' O ' ' O ' ' A' ' 79' ' ' ARG . 0.7 OUTLIER -49.06 133.96 17.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.563 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 79' ' ' ARG . 15.2 ttt-85 -61.18 -135.41 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.61 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.467 ' O ' ' O ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -129.76 -163.55 1.31 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.536 -179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.467 ' O ' ' O ' ' A' ' 80' ' ' TYR . 0.9 OUTLIER 58.3 143.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.721 -179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 83' ' ' VAL . 50.1 p -175.42 -132.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.57 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.475 ' N ' ' OG ' ' A' ' 82' ' ' SER . 1.2 m -86.55 -172.61 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.524 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 111.27 53.33 0.54 Allowed Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 98.6 p -135.82 30.17 3.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.769 0.318 . . . . 0.0 110.659 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -96.64 149.31 21.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.356 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.465 ' O ' ' C ' ' A' ' 88' ' ' ASP . . . -98.15 93.43 6.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.755 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.526 ' O ' ' C ' ' A' ' 89' ' ' THR . 1.9 m-20 -35.21 -61.9 0.41 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.473 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.526 ' C ' ' O ' ' A' ' 88' ' ' ASP . 6.4 m 29.94 52.55 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.543 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -165.22 25.58 0.05 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.4 -166.46 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.854 -179.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.865 HG23 ' N ' ' A' ' 93' ' ' ASP . 3.7 tt -170.58 -161.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.571 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.865 ' N ' HG23 ' A' ' 92' ' ' ILE . 9.2 m-20 -97.81 125.41 42.64 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.762 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.63 ' H ' HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -116.12 6.89 14.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.04 -29.11 9.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.443 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -79.49 42.96 2.47 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.817 -0.913 . . . . 0.0 110.817 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.84 159.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.64 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 0.3 OUTLIER -85.57 96.05 9.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.41 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.72 -5.78 55.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.66 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -49.36 -20.57 0.69 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -51.62 -49.61 61.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.774 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 104' ' ' ARG . 1.2 tp -71.37 -53.67 13.35 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.15 0.5 . . . . 0.0 110.696 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.421 ' C ' ' O ' ' A' ' 102' ' ' LEU . 26.1 tp60 -43.83 -18.6 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.588 ' N ' ' O ' ' A' ' 102' ' ' LEU . 1.4 mtp180 -86.64 -38.96 16.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.609 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -54.28 -57.78 9.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.398 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.517 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.64 -57.22 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.756 0.788 . . . . 0.0 109.868 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -44.09 -39.61 4.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.343 -1.299 . . . . 0.0 110.128 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.65 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.3 OUTLIER -59.15 -44.23 92.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.923 179.482 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.45 ' C ' ' N ' ' A' ' 111' ' ' ALA . 2.7 t -68.4 -48.34 64.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.51 -17.25 0.76 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.65 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -80.19 -58.85 2.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.039 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -46.82 -25.81 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 115' ' ' ARG . 31.9 t -90.75 -43.31 10.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.864 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.453 ' C ' ' O ' ' A' ' 113' ' ' SER . 34.8 t-20 -37.25 -23.49 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.638 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.648 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -105.75 -45.14 4.47 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.857 179.302 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.457 ' H ' ' HG2' ' A' ' 115' ' ' ARG . . . -79.07 20.95 0.46 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.679 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.452 ' H ' ' C ' ' A' ' 115' ' ' ARG . 53.8 t80 -117.2 -81.59 0.62 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.786 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.414 ' HG2' ' H ' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -69.26 93.41 0.62 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.648 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -118.31 44.64 2.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.61 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 t -75.98 152.63 36.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.542 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 160.03 56.27 0.01 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 13.6 tt -75.72 134.41 29.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.799 0.333 . . . . 0.0 110.58 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.547 ' O ' ' C ' ' A' ' 124' ' ' ASP . 0.3 OUTLIER -120.95 -15.93 8.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.223 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.547 ' C ' ' O ' ' A' ' 123' ' ' THR . 7.0 p-10 24.06 50.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.9 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 123' ' ' THR . 0.1 OUTLIER -76.1 -41.03 51.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.248 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -39.54 74.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.221 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.513 ' C ' ' CD ' ' A' ' 127' ' ' GLN . 0.7 OUTLIER -71.18 -35.71 71.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.907 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.4 -70.98 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.364 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.4 mt -44.68 -39.14 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.4 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 t -55.69 -56.69 17.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.412 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 27.7 ttt-85 -52.3 -51.69 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.05 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.592 ' O ' ' OG ' ' A' ' 136' ' ' SER . 33.2 t -47.46 -71.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.162 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.513 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.1 OUTLIER -30.03 -68.78 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.317 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.619 ' C ' ' H ' ' A' ' 136' ' ' SER . 29.2 tt0 -48.29 -59.85 3.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.717 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.18 4.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.694 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.619 ' H ' ' C ' ' A' ' 134' ' ' GLU . 0.8 OUTLIER -113.65 -22.87 10.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.658 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.434 HG13 ' H ' ' A' ' 138' ' ' ALA . 5.4 pt -108.45 -42.74 5.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.434 ' H ' HG13 ' A' ' 137' ' ' ILE . . . 40.75 51.05 3.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.331 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -89.38 126.95 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.824 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -130.29 -92.67 0.43 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.301 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt 52.36 88.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.717 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -52.79 149.26 6.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.244 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 121.57 10.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.563 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.559 ' O ' ' O ' ' A' ' 145' ' ' LYS . 1.1 mm? -101.58 -53.71 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.532 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.559 ' O ' ' O ' ' A' ' 144' ' ' LEU . 12.3 tttp 53.31 150.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.828 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.491 ' CB ' ' CZ ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.633 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttp . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.438 ' O ' ' OG1' ' A' ' 2' ' ' THR . 0.5 OUTLIER -143.2 55.66 1.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.526 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.596 ' O ' HG22 ' A' ' 3' ' ' VAL . 1.9 p -77.62 88.18 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.299 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 48.44 12.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.97 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.597 ' N ' ' OE1' ' A' ' 5' ' ' GLN . 1.3 pm0 -56.25 149.04 17.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.358 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.551 ' C ' ' H ' ' A' ' 8' ' ' LEU . 23.3 t-20 179.4 125.54 0.07 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.674 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -67.72 38.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.582 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.698 HD12 ' O ' ' A' ' 8' ' ' LEU . 1.5 tp -35.08 -50.57 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.229 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -113.54 121.92 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.421 ' C ' ' H ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER -161.55 1.15 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.464 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 p -63.47 -1.48 1.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.556 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.421 ' H ' ' C ' ' A' ' 10' ' ' GLN . . . -77.88 -31.53 51.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.363 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.87 -37.03 63.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.652 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.483 ' C ' ' CD ' ' A' ' 14' ' ' GLN . 3.1 pp0? -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.709 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -75.74 -34.43 60.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.513 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -68.34 -58.67 4.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.442 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.653 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 8.6 mp0 -54.22 -26.91 31.09 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 4.4 mm100 -64.19 -56.52 14.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.191 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.606 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -75.53 -47.99 24.46 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.331 0.586 . . . . 0.0 110.533 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.606 ' N ' ' CG2' ' A' ' 19' ' ' THR . 61.4 t80 -46.79 -50.56 18.09 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.204 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.583 HD21 ' HA ' ' A' ' 37' ' ' GLN . 54.0 mt -69.33 -52.02 31.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.157 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 9.5 t30 -45.17 -37.9 4.85 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.635 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -61.63 -55.72 27.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.881 178.364 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 36' ' ' LEU . 9.0 mt -45.82 -21.87 0.15 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.256 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -87.9 -23.4 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.137 179.275 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.635 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.6 tt0 -87.53 -58.22 2.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.82 -59.89 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.444 -177.475 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -84.59 -5.51 59.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 -179.278 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.75 32.6 74.37 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.204 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 31' ' ' ASN . 4.4 mm -89.77 161.23 2.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.963 0.382 . . . . 0.0 110.986 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' HG22 ' A' ' 30' ' ' ILE . 23.5 m-20 -125.15 -21.13 4.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.524 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.453 ' CB ' HD12 ' A' ' 35' ' ' ILE . 3.8 m-20 -67.2 124.68 23.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.532 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m -82.89 -21.96 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.351 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -43.0 19.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.644 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.453 HD12 ' CB ' ' A' ' 32' ' ' ASP . 62.0 mt -60.85 -43.9 96.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.913 0.387 . . . . 0.0 110.459 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 24' ' ' LEU . 75.9 mt -70.26 -56.78 5.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.583 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -45.59 -27.07 0.69 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.822 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.468 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 0.9 OUTLIER -71.43 -39.55 70.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.135 178.828 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.55 -25.44 65.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.838 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.894 ' C ' HD13 ' A' ' 40' ' ' LEU . 1.2 tm? -72.64 -46.38 54.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.104 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.594 ' N ' HD13 ' A' ' 40' ' ' LEU . 19.8 mmmt -58.64 -31.77 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.658 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.86 -48.33 8.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.607 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 44' ' ' ASN . 88.8 p -63.61 -5.91 4.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.679 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.738 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.2 OUTLIER 59.51 28.6 18.03 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.264 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.28 -11.65 54.92 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.687 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.715 ' OD1' ' ND2' ' A' ' 44' ' ' ASN . 10.8 m120 -85.31 131.88 34.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.054 0.427 . . . . 0.0 110.253 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 50' ' ' ALA . 65.7 tp -81.71 -61.29 1.97 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.211 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.536 ' C ' HD22 ' A' ' 49' ' ' LEU . 1.4 mt-10 -40.89 -25.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.055 0.455 . . . . 0.0 109.81 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.3 mm? -90.05 -35.24 15.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.59 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -63.79 -52.2 61.33 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.79 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.5 p -56.64 -56.48 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.79 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.71 -36.17 56.92 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.462 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -54.19 -31.66 53.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.918 178.922 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.595 HD22 HG21 ' A' ' 28' ' ' THR . 8.0 mp -78.68 -55.36 5.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.438 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -81.34 -50.42 9.52 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.223 0.535 . . . . 0.0 109.687 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.77 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 35.11 -157.7 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.335 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.512 ' CB ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER 82.6 82.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.181 -179.356 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 71.7 30.74 2.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.323 -179.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -130.29 -12.48 4.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.021 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.527 ' O ' ' OG1' ' A' ' 61' ' ' THR . 1.7 tttt -53.97 159.68 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.802 0.334 . . . . 0.0 110.577 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 60' ' ' LYS . 34.3 m -171.16 75.75 0.53 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.615 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.428 ' HG2' ' H ' ' A' ' 63' ' ' GLN . 72.9 Cg_endo -84.68 -70.0 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 123.066 2.51 . . . . 0.0 112.14 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.604 ' O ' ' C ' ' A' ' 64' ' ' GLN . 39.1 tt0 46.71 93.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.678 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 63' ' ' GLN . 1.4 pt20 7.53 87.55 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.497 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.544 ' CG ' ' N ' ' A' ' 66' ' ' GLU . 52.8 tt0 -56.54 166.34 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.651 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.544 ' N ' ' CG ' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -129.69 88.51 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.661 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 m -104.76 85.53 2.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.5 m -133.49 121.59 22.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.567 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.527 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.2 OUTLIER -120.3 52.27 1.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.151 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.527 ' C ' ' O ' ' A' ' 69' ' ' TYR . 0.2 OUTLIER -28.86 -62.42 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 -179.795 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.625 ' C ' ' H ' ' A' ' 73' ' ' ALA . 49.5 tt0 -34.61 -66.52 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.248 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m 66.3 -20.9 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.625 ' H ' ' C ' ' A' ' 71' ' ' GLN . . . 57.35 72.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.484 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.54 68.64 80.66 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.499 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -42.57 -40.05 7.3 Favored 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 122.81 2.34 . . . . 0.0 112.028 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.5 106.47 2.94 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.488 ' N ' ' OD1' ' A' ' 77' ' ' ASN . 0.1 OUTLIER -106.92 -7.46 17.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.844 0.354 . . . . 0.0 110.323 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.527 ' O ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -50.69 175.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.694 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.527 ' O ' ' O ' ' A' ' 78' ' ' ASP . 31.2 mtt-85 49.81 110.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.459 ' CD1' ' N ' ' A' ' 80' ' ' TYR . 7.5 m-85 -65.7 -57.32 8.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.481 ' H ' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -127.79 -150.36 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.296 179.874 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.629 ' O ' HG13 ' A' ' 83' ' ' VAL . 29.0 t -141.61 -75.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.51 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 82' ' ' SER . 5.8 m -159.37 124.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.516 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -121.42 -104.28 1.89 Allowed Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.52 -51.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.656 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -95.12 -158.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.652 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.03 93.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.657 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.437 ' O ' ' O ' ' A' ' 89' ' ' THR . 5.3 t0 -82.45 49.82 1.52 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.353 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 88' ' ' ASP . 22.9 m 47.5 97.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.074 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 176.61 37.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.656 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 91' ' ' VAL . 0.1 OUTLIER -91.22 -179.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.227 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.857 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.3 OUTLIER 179.69 -159.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.802 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.857 ' N ' HG23 ' A' ' 92' ' ' ILE . 4.5 t70 90.5 161.29 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.393 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.9 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.7 mp -64.61 -31.85 73.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.71 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -25.78 3.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.67 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.502 ' H ' ' HB3' ' A' ' 93' ' ' ASP . . . 53.16 19.01 7.1 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 98' ' ' ASP . 55.1 t0 -73.25 127.14 31.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.89 0.376 . . . . 0.0 110.557 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 34.4 m-20 -66.16 106.07 1.55 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.726 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.5 mtmp? -90.86 -8.77 48.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.477 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.55 -42.34 78.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.051 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -82.35 -21.81 35.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.176 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 105' ' ' ALA . 5.1 tt -73.02 -50.08 25.13 Favored 'General case' 0 CA--C 1.51 -0.561 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.1 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.656 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.5 mt-30 -46.01 -20.12 0.08 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 178.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.533 ' N ' ' C ' ' A' ' 102' ' ' LEU . 0.8 OUTLIER -87.1 -31.53 20.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.436 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.611 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.1 -57.29 13.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.259 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -74.05 -34.1 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.15 -179.308 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.769 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -61.51 -58.22 9.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.71 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.659 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 36.8 mt -47.27 -44.79 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.781 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.488 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -61.27 -46.2 91.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.056 179.542 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.51 -18.54 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -82.3 -55.47 4.5 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.533 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.474 ' HA ' ' HE ' ' A' ' 115' ' ' ARG . 69.3 mm-40 -45.95 -22.72 0.22 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.69 ' O ' ' N ' ' A' ' 115' ' ' ARG . 19.1 m -90.4 -49.38 6.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.142 179.251 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.435 ' C ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -36.88 -20.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.994 179.661 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.69 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.6 OUTLIER -108.43 -33.84 6.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.49 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.543 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -91.8 6.83 44.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.932 0.396 . . . . 0.0 110.143 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.534 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -85.47 179.86 7.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.488 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.693 ' CD ' ' H ' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -41.88 -33.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.652 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.587 ' O ' ' C ' ' A' ' 120' ' ' THR . 8.3 pt-20 24.19 50.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.863 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 121' ' ' GLY . 0.0 OUTLIER -10.33 -65.36 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.468 179.883 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLY . . . . . 0.604 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 74.21 162.84 8.94 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 18.2 tt -58.62 165.18 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.74 0.305 . . . . 0.0 110.386 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 p -149.82 91.31 1.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.574 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -120.76 -0.98 10.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.667 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.18 -43.58 70.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.576 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.84 -39.8 62.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.432 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -68.94 -34.08 74.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.68 -70.38 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.768 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.0 pp -39.49 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.798 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.1 m -72.43 -78.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.899 0.381 . . . . 0.0 110.89 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.612 ' CA ' ' HE ' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -25.74 -56.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.324 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 133' ' ' LEU . 7.2 p -57.72 -69.72 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.345 -179.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.991 ' H ' HG13 ' A' ' 132' ' ' VAL . 0.5 OUTLIER -42.34 -54.19 3.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.811 0.338 . . . . 0.0 110.654 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.498 ' O ' ' HB3' ' A' ' 138' ' ' ALA . 34.2 mm-40 -41.18 -51.5 3.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.598 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.6 -23.58 59.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 133' ' ' LEU . 74.6 m -86.2 -77.81 0.3 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.816 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.493 HG23 ' N ' ' A' ' 138' ' ' ALA . 14.3 tt -43.87 -40.88 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.861 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 134' ' ' GLU . . . -65.28 82.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.916 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -71.03 132.53 45.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.326 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.82 143.67 44.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.586 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -124.63 123.77 40.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.77 -27.42 22.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.468 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.406 ' SG ' ' N ' ' A' ' 144' ' ' LEU . 6.0 t 54.86 -152.6 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.678 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.406 ' N ' ' SG ' ' A' ' 143' ' ' CYS . 15.2 tp 68.08 52.64 0.67 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.791 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -116.69 24.95 10.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.267 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 146' ' ' ARG . 16.5 ttt-85 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.549 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ptm . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.579 ' O ' ' N ' ' A' ' 4' ' ' GLU . 2.0 m -103.68 -10.5 18.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.642 ' O ' HG13 ' A' ' 3' ' ' VAL . 9.8 p 23.24 45.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.059 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.61 ' C ' ' O ' ' A' ' 3' ' ' VAL . 3.5 mt-10 5.1 79.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.582 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.541 ' HG2' HG13 ' A' ' 3' ' ' VAL . 0.5 OUTLIER -65.58 -118.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.948 0.404 . . . . 0.0 110.68 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.429 ' OD1' ' C ' ' A' ' 5' ' ' GLN . 4.4 p-10 172.7 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.431 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.423 HG23 ' N ' ' A' ' 8' ' ' LEU . 8.3 m -131.38 -45.04 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.559 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.423 ' N ' HG23 ' A' ' 7' ' ' VAL . 0.7 OUTLIER 177.87 134.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.565 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.3 67.59 4.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.533 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.54 ' O ' ' C ' ' A' ' 11' ' ' SER . 2.2 pt20 -51.47 162.13 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.814 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.54 ' C ' ' O ' ' A' ' 10' ' ' GLN . 2.8 p 24.11 85.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.13 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.48 -21.4 35.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.863 0.363 . . . . 0.0 110.269 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.63 -47.05 70.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.317 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -50.72 -23.32 2.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.566 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -63.59 -18.99 64.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.513 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -56.88 -54.49 45.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.663 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -51.09 -45.25 61.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.29 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -46.65 -50.95 16.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.397 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.576 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -72.6 -49.33 32.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.194 0.521 . . . . 0.0 110.872 -179.62 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.576 ' N ' ' CG2' ' A' ' 19' ' ' THR . 35.1 t80 -46.46 -58.91 3.32 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.9 mt -66.26 -49.84 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.217 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -45.54 -40.35 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 26' ' ' GLU . 13.2 mm-40 -61.46 -50.09 74.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.765 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.616 HD21 ' CB ' ' A' ' 50' ' ' ALA . 29.9 mt -44.28 -30.95 0.89 Allowed 'General case' 0 C--O 1.226 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.132 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.49 ' CD ' ' C ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -84.59 -18.99 33.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.08 0.467 . . . . 0.0 110.031 179.232 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.674 ' N ' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -87.4 -55.03 3.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.674 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.513 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -62.27 -59.58 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -177.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -89.15 -3.72 58.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.577 -178.088 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.437 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 66.08 32.68 83.15 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.304 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.681 ' O ' HD11 ' A' ' 36' ' ' LEU . 39.5 mm -106.97 107.48 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 117.449 0.625 . . . . 0.0 110.945 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.659 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -79.91 -20.11 46.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.678 -179.474 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 55.3 m-20 -44.51 84.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.224 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.659 ' N ' ' O ' ' A' ' 31' ' ' ASN . 8.6 t -51.79 -24.47 6.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.866 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.488 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.67 -40.65 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.187 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.488 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 10.7 mt -75.36 -29.41 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.086 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.681 HD11 ' O ' ' A' ' 30' ' ' ILE . 3.2 mt -70.2 -44.81 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.527 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 2.7 pt20 -64.19 -28.75 69.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.386 . . . . 0.0 110.147 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 46.6 tt0 -79.59 -38.29 34.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.05 69.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.503 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -77.06 -40.33 46.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.127 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.732 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.64 -35.64 70.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.7 OUTLIER -86.09 -46.23 10.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.034 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.623 ' O ' ' N ' ' A' ' 45' ' ' GLY . 5.8 m -66.26 18.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.962 0.41 . . . . 0.0 111.01 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.595 ' H ' ' C ' ' A' ' 42' ' ' ASP . 4.5 p-10 31.77 28.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.108 179.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.623 ' N ' ' O ' ' A' ' 43' ' ' SER . . . 97.5 26.53 9.89 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.945 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.605 ' N ' ' O ' ' A' ' 43' ' ' SER . 8.0 m120 -108.68 131.0 55.34 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.513 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.56 -63.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.728 -177.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.575 ' C ' HD22 ' A' ' 49' ' ' LEU . 52.4 tt0 -49.13 -20.83 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.795 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.1 mm? -89.44 -52.57 4.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.486 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.616 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -53.81 -47.77 70.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.684 HG13 ' N ' ' A' ' 52' ' ' ALA . 6.5 p -62.96 -50.71 78.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.119 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.764 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -60.33 -28.72 68.37 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.669 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.502 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.7 OUTLIER -61.91 -37.16 83.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.048 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.551 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -71.4 -57.62 4.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.605 ' O ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -82.11 -50.58 8.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.936 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.764 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 34.61 26.67 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.884 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -167.85 -34.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.813 0.34 . . . . 0.0 110.492 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.611 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 2.1 t-20 -89.57 -145.99 0.17 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.819 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 75.92 102.84 0.07 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.629 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.07 -68.19 0.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.115 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.788 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 0.1 OUTLIER -140.78 -42.66 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.332 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.998 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.788 ' CD ' ' H ' ' A' ' 61' ' ' THR . 9.2 Cg_endo -86.44 56.57 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.193 2.595 . . . . 0.0 111.75 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -130.82 15.04 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.677 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -138.33 48.36 1.95 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.436 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -80.31 172.53 13.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.607 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -100.41 131.86 46.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.817 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.2 m -156.12 127.73 7.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.293 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.6 p -120.32 158.33 27.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.681 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.542 ' CE1' ' O ' ' A' ' 70' ' ' TYR . 18.1 t80 179.65 130.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.473 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.548 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -125.45 -174.3 3.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.67 -179.861 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.463 ' O ' HG23 ' A' ' 72' ' ' THR . 1.8 tp-100 -103.49 140.82 36.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.464 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.463 HG23 ' O ' ' A' ' 71' ' ' GLN . 23.5 p -155.45 124.08 6.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.637 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.458 ' HB1' ' HD3' ' A' ' 75' ' ' PRO . . . -175.13 160.88 2.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.322 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.528 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.5 OUTLIER -151.98 49.07 0.51 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.792 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 30.8 Cg_endo -65.9 -9.98 25.15 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.857 2.371 . . . . 0.0 112.2 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -42.03 96.58 0.01 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 75' ' ' PRO . 2.8 t-20 -86.73 163.06 17.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.801 0.334 . . . . 0.0 110.785 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 79' ' ' ARG . 4.8 t0 -169.88 134.28 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.633 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.633 ' O ' ' CG ' ' A' ' 80' ' ' TYR . 0.0 OUTLIER -138.57 -173.78 3.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.282 179.796 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.633 ' CG ' ' O ' ' A' ' 79' ' ' ARG . 87.6 m-85 -163.01 165.07 25.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.191 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.9 mt 66.46 87.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.433 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 54.7 p -135.03 93.32 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.405 ' H ' HG22 ' A' ' 83' ' ' VAL . 3.4 m -47.99 129.03 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.455 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -164.57 55.05 0.27 Allowed Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.65 29.98 6.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.35 . . . . 0.0 110.383 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 70.38 -142.47 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.541 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 179.8 130.21 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.706 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.549 ' O ' ' C ' ' A' ' 89' ' ' THR . 24.4 t0 -162.87 47.09 0.14 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.62 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.549 ' C ' ' O ' ' A' ' 88' ' ' ASP . 3.1 t 24.58 51.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.413 ' N ' ' O ' ' A' ' 88' ' ' ASP . 2.3 t-20 -174.25 40.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.231 0.538 . . . . 0.0 109.652 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.591 ' O ' ' O ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -115.14 -60.6 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.449 -178.821 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.785 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.9 tt -49.13 -161.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.349 0.595 . . . . 0.0 111.206 -178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.785 ' N ' HG23 ' A' ' 92' ' ' ILE . 11.0 m-20 -27.75 152.1 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.916 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.03 -38.4 10.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.765 HG23 ' H ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -74.25 -62.95 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.534 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.765 ' H ' HG23 ' A' ' 95' ' ' THR . . . 75.18 78.5 0.63 Allowed Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -68.5 91.26 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.753 0.311 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -117.15 96.13 5.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.631 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.19 -14.38 31.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.632 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.22 -20.6 65.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.761 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -87.83 -44.72 10.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.781 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.649 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.3 mt -66.67 -51.84 51.61 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.012 0.434 . . . . 0.0 110.693 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 102' ' ' LEU . 5.4 tp60 -43.82 -18.85 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.6 ' N ' ' O ' ' A' ' 102' ' ' LEU . 3.5 ttp180 -86.76 -35.45 19.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.166 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.649 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -67.39 -47.99 68.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.117 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.759 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.83 -32.81 59.67 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.214 0.531 . . . . 0.0 110.451 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.81 -52.6 23.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.451 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 63.1 tp -46.33 -53.0 11.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.644 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.483 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER -63.79 -46.68 84.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.421 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.04 -17.46 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.95 -58.42 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.782 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -46.23 -22.4 0.23 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.86 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.672 ' O ' ' N ' ' A' ' 115' ' ' ARG . 8.6 t -90.04 -50.78 5.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.502 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 113' ' ' SER . 1.9 m-20 -39.18 -18.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.975 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.672 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -105.14 -39.65 6.14 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -89.64 31.06 0.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.131 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -125.67 172.08 10.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.833 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.55 ' O ' ' C ' ' A' ' 119' ' ' GLU . 1.8 ptp85 166.29 -43.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.962 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.55 ' C ' ' O ' ' A' ' 118' ' ' ARG . 1.7 tt0 23.26 60.67 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.033 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.7 t -75.82 155.6 35.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -113.33 -167.64 16.72 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 15.1 tt -140.49 132.91 32.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.556 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.499 ' O ' ' CG ' ' A' ' 124' ' ' ASP . 5.3 m -56.72 -65.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.624 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.499 ' CG ' ' O ' ' A' ' 123' ' ' THR . 2.4 m-20 174.41 38.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.327 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 -22.34 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.632 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.03 -53.12 42.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.74 -39.26 90.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.543 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -63.16 -69.37 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.484 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 128' ' ' ALA . 5.0 mm -37.86 -48.34 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.696 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -60.72 2.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HD2' HH11 ' A' ' 131' ' ' ARG . 3.9 mmt180 -59.08 -55.77 30.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' A' ' 135' ' ' ALA . 82.9 t -48.02 -66.39 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.425 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.75 ' O ' HD23 ' A' ' 133' ' ' LEU . 5.3 tt -34.57 -48.87 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.631 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.551 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -62.51 -30.89 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.5 m -80.55 -16.21 54.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.692 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.527 ' O ' ' C ' ' A' ' 138' ' ' ALA . 4.5 mm -93.27 -20.62 6.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.757 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.527 ' C ' ' O ' ' A' ' 137' ' ' ILE . . . -29.58 -69.31 0.06 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.353 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -115.59 32.62 5.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.288 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 3.9 m120 55.8 -130.27 1.91 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.419 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.06 118.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.477 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -160.34 26.9 0.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.213 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.61 ' O ' ' N ' ' A' ' 145' ' ' LYS . 0.8 OUTLIER 51.48 -167.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.315 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.472 ' C ' ' O ' ' A' ' 143' ' ' CYS . 1.4 mm? 34.27 28.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.62 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 143' ' ' CYS . 0.6 OUTLIER -77.34 152.16 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.291 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.4 mtm180 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.505 179.942 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tmm? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.614 ' O ' ' N ' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -129.94 -78.77 0.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.641 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.652 ' O ' HG13 ' A' ' 3' ' ' VAL . 6.3 p 24.3 41.55 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.006 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.614 ' N ' ' O ' ' A' ' 2' ' ' THR . 30.8 tt0 -52.15 143.66 13.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.382 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.408 ' C ' ' O ' ' A' ' 4' ' ' GLU . 19.1 tp60 -39.35 129.25 1.8 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.457 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -138.84 73.43 1.43 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.837 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.0 m -108.77 5.32 9.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.511 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.49 -21.94 57.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.58 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -80.39 89.73 5.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -69.14 -164.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.572 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.3 32.52 0.52 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.37 -42.86 29.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.5 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.35 -19.5 64.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.583 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -48.35 -33.73 9.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.003 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -89.26 -51.92 5.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.92 -60.32 1.99 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -84.51 -60.87 1.94 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.763 -177.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -46.8 -32.4 3.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.385 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.603 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -69.37 -49.83 51.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.461 0.648 . . . . 0.0 110.081 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.603 ' N ' ' CG2' ' A' ' 19' ' ' THR . 74.9 t80 -60.1 -49.52 77.31 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.604 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -39.55 89.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.16 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 12.0 t30 -59.25 -39.37 82.63 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.7 mm-40 -56.83 -51.64 68.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.138 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.666 ' HB3' HD22 ' A' ' 36' ' ' LEU . 4.5 mt -45.75 -41.26 10.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.332 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.661 ' NH2' ' OE1' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -69.7 -18.45 63.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.717 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.661 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 1.3 tp10 -85.89 -58.43 2.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.519 ' CD1' ' H ' ' A' ' 27' ' ' ILE . 0.1 OUTLIER -64.43 -59.41 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.493 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -83.24 -2.91 56.77 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.501 -178.734 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 62.7 20.23 61.54 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.032 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.673 HG21 HD21 ' A' ' 36' ' ' LEU . 9.1 mm -65.62 160.36 3.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 117.094 0.447 . . . . 0.0 110.628 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 5.6 t-20 -117.12 -56.92 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.298 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.474 ' HB3' HD12 ' A' ' 35' ' ' ILE . 1.1 t0 -48.53 111.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.621 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.2 p -71.99 -19.88 61.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.728 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -70.65 -43.08 69.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.594 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' A' ' 32' ' ' ASP . 90.9 mt -62.05 -40.85 88.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.554 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.673 HD21 HG21 ' A' ' 30' ' ' ILE . 16.3 mt -60.45 -62.1 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.451 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -43.41 -28.05 0.32 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' N ' ' C ' ' A' ' 36' ' ' LEU . 2.1 tp60 -76.09 -38.96 56.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.854 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.558 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.42 -38.07 84.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.075 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -62.29 -37.26 84.85 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.488 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.9 -43.38 94.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.067 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -78.67 -46.07 19.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.147 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.6 p -66.63 -31.57 72.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.307 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 67.3 47.08 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.728 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.587 ' H ' HD22 ' A' ' 40' ' ' LEU . . . 94.15 -14.33 65.52 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.02 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -80.12 124.94 29.21 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 49' ' ' LEU . 32.8 tp -85.02 -62.7 1.48 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.324 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 3.7 tt0 -42.44 -20.87 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.688 HD22 ' N ' ' A' ' 49' ' ' LEU . 4.0 mm? -86.3 -50.19 7.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.608 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.627 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -58.2 -56.82 17.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.647 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 3.7 p -49.67 -46.89 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.681 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -60.08 -36.29 77.04 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.401 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -64.39 -36.13 83.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.253 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 50' ' ' ALA . 4.4 mm? -69.34 -57.49 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.179 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.619 HG23 ' N ' ' A' ' 56' ' ' ALA . 9.9 t -79.29 -48.5 14.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.391 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.681 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 30.27 -129.67 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.049 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.39 -163.53 0.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.464 ' HA ' ' HZ2' ' A' ' 60' ' ' LYS . 12.1 t30 -178.7 163.48 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.857 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 67.65 61.08 0.45 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.949 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.531 ' HG2' ' N ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -121.05 -34.07 3.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.103 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.531 ' N ' ' HG2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER 167.97 86.6 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.074 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.634 ' C ' ' H ' ' A' ' 64' ' ' GLN . 57.5 Cg_endo -88.58 -153.56 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 123.146 2.564 . . . . 0.0 111.8 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 61.71 -9.75 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.82 0.343 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.634 ' H ' ' C ' ' A' ' 62' ' ' PRO . 61.2 mm-40 -136.87 56.93 1.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -136.69 130.13 31.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.524 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -162.13 111.08 1.45 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.382 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.573 ' O ' ' OG1' ' A' ' 68' ' ' THR . 3.9 t -44.25 110.22 0.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.533 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.573 ' OG1' ' O ' ' A' ' 67' ' ' THR . 11.4 m -178.78 -57.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.724 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 61.35 100.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.271 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -73.99 -176.83 2.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.659 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -91.98 133.66 35.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.381 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 5.1 p -128.24 -28.84 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.472 ' HB1' ' HD3' ' A' ' 75' ' ' PRO . . . -61.3 135.43 57.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.515 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.535 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -125.71 49.58 3.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.504 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 26.9 Cg_endo -65.66 64.03 0.4 Allowed 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.69 2.26 . . . . 0.0 112.067 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.523 ' C ' ' O ' ' A' ' 75' ' ' PRO . . . -28.67 118.14 0.06 OUTLIER Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.931 -0.867 . . . . 0.0 110.931 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.424 HD21 ' HA ' ' A' ' 77' ' ' ASN . 1.3 t-20 -116.95 113.79 22.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.625 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -98.86 130.25 45.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.32 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.651 ' C ' ' H ' ' A' ' 81' ' ' ILE . 3.5 ttm180 -155.84 -34.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.568 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.462 ' O ' HG23 ' A' ' 81' ' ' ILE . 3.4 m-85 64.57 -28.71 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.633 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.651 ' H ' ' C ' ' A' ' 79' ' ' ARG . 0.1 OUTLIER -158.72 -176.06 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.29 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.527 ' O ' ' C ' ' A' ' 83' ' ' VAL . 5.0 m -121.8 -173.88 2.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.627 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.527 ' C ' ' O ' ' A' ' 82' ' ' SER . 90.0 t -29.13 111.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.569 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.574 ' C ' ' H ' ' A' ' 86' ' ' GLN . . . -59.41 -49.35 79.51 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.21 -10.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.846 0.355 . . . . 0.0 110.496 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.574 ' H ' ' C ' ' A' ' 84' ' ' GLY . 0.5 OUTLIER -150.28 165.29 33.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.459 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.05 127.88 33.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.586 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -101.47 -16.82 16.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.748 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 t -49.57 161.66 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.512 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -179.49 29.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.316 0.579 . . . . 0.0 109.718 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.678 ' C ' HG22 ' A' ' 92' ' ' ILE . 0.4 OUTLIER -86.46 167.92 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.857 -179.482 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.678 HG22 ' C ' ' A' ' 91' ' ' VAL . 1.3 tt 163.23 165.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.749 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.645 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -105.43 143.05 34.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.791 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD12 ' N ' ' A' ' 95' ' ' THR . 1.9 pp -123.07 -33.75 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.667 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.713 HG23 ' H ' ' A' ' 97' ' ' ASP . 9.9 t -94.74 -13.35 25.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.585 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.488 ' O ' ' CB ' ' A' ' 97' ' ' ASP . . . 105.83 -12.7 45.96 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.713 ' H ' HG23 ' A' ' 95' ' ' THR . 0.6 OUTLIER 162.26 -83.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.667 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -88.01 149.21 24.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -84.11 -12.78 54.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.536 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -68.78 -21.39 64.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.594 ' OD2' ' NH2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -54.59 -17.4 3.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.573 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.843 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -60.57 -35.45 76.09 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 120.53 -0.468 . . . . 0.0 109.793 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.465 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.6 OUTLIER -56.25 -18.69 11.18 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.594 ' NH2' ' OD2' ' A' ' 101' ' ' ASP . 0.4 OUTLIER -82.38 -37.91 24.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.652 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.82 -49.02 76.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.98 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.465 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -62.25 -40.95 89.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 109.75 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.0 -48.15 76.41 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.526 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 108' ' ' LEU . 6.2 tp -55.89 -34.51 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.824 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.462 ' C ' ' N ' ' A' ' 111' ' ' ALA . 58.2 m -78.07 -49.69 13.48 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.575 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -48.06 -18.29 0.18 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.462 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.86 -58.25 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.457 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -46.25 -26.29 0.77 Allowed 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.583 ' O ' ' N ' ' A' ' 115' ' ' ARG . 35.9 t -85.21 -43.77 13.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.987 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 113' ' ' SER . 63.3 t30 -42.42 -18.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.583 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -102.85 -44.65 5.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.24 179.59 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.07 11.24 4.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.168 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.47 ' CD2' ' HG3' ' A' ' 118' ' ' ARG . 32.4 t80 -87.51 -104.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.618 ' O ' ' N ' ' A' ' 120' ' ' THR . 52.6 mtt180 -82.97 40.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.795 0.331 . . . . 0.0 110.481 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 118' ' ' ARG . 3.7 pt-20 23.73 42.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.126 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.618 ' N ' ' O ' ' A' ' 118' ' ' ARG . 1.8 p -47.09 169.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.295 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -164.39 27.36 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.7 tp -42.42 157.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 16.8 p -135.75 151.92 50.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.629 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.03 -84.0 0.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.96 -47.95 80.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.605 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 130' ' ' SER . 1.5 tt0 -53.26 -34.22 56.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.598 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.497 ' O ' ' OG ' ' A' ' 130' ' ' SER . 16.6 tt0 -65.91 -55.86 14.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.783 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -45.16 -64.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.6 mp -43.9 -39.36 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.525 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.31 -44.27 83.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 131' ' ' ARG . 7.6 tpt180 -50.33 -36.16 30.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.579 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.9 t -75.37 -62.91 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.49 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.556 ' O ' HG22 ' A' ' 137' ' ' ILE . 14.9 mt -44.6 -42.94 7.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -51.57 56.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -74.84 5.61 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.018 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.4 4.08 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.83 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.6 ' O ' ' O ' ' A' ' 138' ' ' ALA . 6.5 tt -145.45 10.84 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 110.761 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.6 ' O ' ' O ' ' A' ' 137' ' ' ILE . . . 21.92 104.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 140' ' ' ASN . 3.9 tp10 -115.4 143.74 44.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.465 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.465 ' CG ' ' H ' ' A' ' 141' ' ' LYS . 33.0 t-20 -132.96 -138.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.684 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.497 ' O ' ' C ' ' A' ' 142' ' ' ALA . 9.1 tttp -149.97 106.78 3.54 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.763 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.497 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . -31.7 109.39 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.729 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 3.2 t -109.35 6.89 24.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 18.5 mt 66.09 142.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.517 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.0 -153.6 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.398 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.424 ' HD3' HH11 ' A' ' 146' ' ' ARG . 7.8 ttm180 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.627 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mpt? . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.55 ' O ' ' NE2' ' A' ' 5' ' ' GLN . 9.1 t -174.28 -36.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.849 0.357 . . . . 0.0 110.472 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.45 HG22 HG23 ' A' ' 2' ' ' THR . 0.1 OUTLIER -82.01 47.54 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.542 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.539 ' O ' ' O ' ' A' ' 5' ' ' GLN . 1.4 tt0 -108.6 -82.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.969 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.642 ' O ' ' ND2' ' A' ' 6' ' ' ASN . 23.0 mm-40 52.55 161.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 5' ' ' GLN . 55.6 m-80 -168.1 88.69 0.25 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.46 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.401 HG12 ' N ' ' A' ' 8' ' ' LEU . 50.4 t -128.72 153.45 38.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.514 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.583 ' O ' ' C ' ' A' ' 9' ' ' GLN . 2.1 tt -165.67 163.33 19.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.583 ' C ' ' O ' ' A' ' 8' ' ' LEU . 0.7 OUTLIER -21.9 -64.65 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.115 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.453 ' CG ' ' O ' ' A' ' 8' ' ' LEU . 4.1 mm-40 40.88 -133.14 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.448 ' OG ' ' N ' ' A' ' 12' ' ' ALA . 87.4 p -156.74 -66.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.953 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' GLN . . . -54.93 -14.24 1.4 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.158 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -42.53 -19.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.874 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' ALA . 40.1 mt-30 -70.61 -40.27 73.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.849 0.357 . . . . 0.0 110.362 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 12' ' ' ALA . 21.4 ttmt -78.6 -18.78 54.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.719 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.27 -20.85 66.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.963 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.451 ' HG2' ' N ' ' A' ' 18' ' ' GLN . 2.4 pt20 -45.37 -39.68 7.12 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.048 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.451 ' N ' ' HG2' ' A' ' 17' ' ' GLN . 5.1 mm-40 -47.13 -56.04 7.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -40.43 66.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.159 0.504 . . . . 0.0 110.326 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -45.47 -63.64 0.91 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.809 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.427 HD22 ' O ' ' A' ' 36' ' ' LEU . 37.8 mt -55.97 -45.12 79.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.253 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 3.4 t-20 -48.56 -43.69 35.85 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.461 0.648 . . . . 0.0 109.43 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.866 ' O ' HD12 ' A' ' 27' ' ' ILE . 26.0 mm-40 -60.64 -55.79 29.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.778 HD21 ' HB1' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -43.8 -19.3 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.768 179.612 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -85.31 -25.29 27.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.566 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.734 ' N ' ' O ' ' A' ' 23' ' ' GLN . 15.0 tt0 -87.06 -58.14 2.7 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.378 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 1.044 ' H ' HD12 ' A' ' 27' ' ' ILE . 2.4 mp -53.54 -60.7 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.536 ' OG1' HD11 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -88.53 -3.12 58.87 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.663 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.13 32.89 62.59 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.556 HG22 ' H ' ' A' ' 32' ' ' ASP . 27.9 mm -81.58 162.16 3.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.191 0.52 . . . . 0.0 111.725 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.525 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -151.27 33.66 0.58 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.525 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.556 ' H ' HG22 ' A' ' 30' ' ' ILE . 24.6 m-20 -111.6 142.81 43.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.325 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 m -83.03 -39.32 21.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.666 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -78.92 -52.05 8.82 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 35' ' ' ILE . 8.1 mm -57.11 -25.17 22.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.639 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -83.69 -26.68 29.61 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.516 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -81.64 -18.35 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -85.16 -32.24 22.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.513 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB2' HD11 ' A' ' 54' ' ' LEU . . . -74.12 -50.19 20.54 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.93 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.629 ' O ' HD12 ' A' ' 40' ' ' LEU . 4.0 tp -58.0 -41.41 83.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.797 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -61.95 -36.38 81.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.165 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.577 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 1.1 t0 -86.6 -20.16 28.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.152 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.543 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -82.96 -30.36 28.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.898 -179.776 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.49 ' CG ' ' C ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 72.9 34.21 1.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.977 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.49 2.15 68.06 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.543 ' O ' ' OG ' ' A' ' 43' ' ' SER . 52.6 m-20 -96.61 126.06 41.52 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -79.75 -64.02 1.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.54 -177.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 31.8 tt0 -43.2 -21.44 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.739 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.0 mm? -88.05 -43.83 11.41 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.689 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.778 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -60.21 -55.13 37.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.821 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.4 p -54.53 -57.34 6.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 121.856 0.836 . . . . 0.0 109.063 178.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.821 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -49.86 -42.09 46.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.875 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -52.09 -32.32 34.49 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.626 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 54' ' ' LEU . 7.8 mp -74.44 -57.74 3.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.128 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.21 -50.71 12.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.348 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.738 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -50.35 169.24 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.089 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -117.87 -20.23 8.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.057 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.73 -151.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.345 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -168.08 126.59 1.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.962 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -118.77 -138.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.488 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.451 ' N ' ' HD3' ' A' ' 62' ' ' PRO . 20.0 p -147.09 65.27 9.53 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 121.127 0.489 . . . . 0.0 110.684 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.665 ' CD ' HD11 ' A' ' 49' ' ' LEU . 72.9 Cg_endo -87.29 -91.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 123.524 2.816 . . . . 0.0 112.114 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 61.81 -17.79 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.287 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.61 ' H ' ' C ' ' A' ' 62' ' ' PRO . 5.8 mp0 50.63 54.41 11.24 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.238 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.563 ' C ' ' O ' ' A' ' 64' ' ' GLN . 52.2 tp10 -22.05 107.74 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.951 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.502 ' OE1' ' OG1' ' A' ' 68' ' ' THR . 2.4 tt0 -151.33 150.38 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.805 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.44 ' N ' ' HG2' ' A' ' 66' ' ' GLU . 0.1 OUTLIER -113.86 118.77 35.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.396 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.502 ' OG1' ' OE1' ' A' ' 66' ' ' GLU . 0.3 OUTLIER -137.06 -153.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.627 -179.859 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.677 ' CD2' ' O ' ' A' ' 70' ' ' TYR . 19.3 p90 -166.81 143.39 4.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.549 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.677 ' O ' ' CD2' ' A' ' 69' ' ' TYR . 75.0 m-85 -57.82 -160.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.569 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -123.8 -15.05 7.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.6 m 43.2 66.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.388 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.12 -174.1 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' N ' ' HD3' ' A' ' 75' ' ' PRO . 0.7 OUTLIER -141.86 59.85 10.22 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.647 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 74' ' ' LEU . 7.3 Cg_exo -66.33 -1.89 6.24 Favored 'Trans proline' 0 C--N 1.302 -1.88 0 C-N-CA 122.37 2.047 . . . . 0.0 112.058 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.9 99.36 2.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.605 ' O ' ' CB ' ' A' ' 78' ' ' ASP . 5.2 t-20 -84.19 104.85 14.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.765 0.316 . . . . 0.0 110.526 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.605 ' CB ' ' O ' ' A' ' 77' ' ' ASN . 10.6 t0 89.11 58.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.449 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.515 ' O ' ' O ' ' A' ' 80' ' ' TYR . 1.2 mmt85 -158.93 102.02 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.662 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.515 ' O ' ' O ' ' A' ' 79' ' ' ARG . 5.6 m-85 56.1 143.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.78 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER 64.55 56.51 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.545 ' O ' ' C ' ' A' ' 83' ' ' VAL . 3.4 t -60.55 138.14 58.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.458 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.545 ' C ' ' O ' ' A' ' 82' ' ' SER . 8.6 p -25.94 137.81 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.756 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -92.82 -90.66 1.52 Allowed Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.17 25.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.707 0.289 . . . . 0.0 110.603 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.72 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 81.7 mt-30 -42.17 154.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.28 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.72 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . 160.14 79.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.725 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -73.6 -2.48 23.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.319 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 120.05 18.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.595 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -178.78 35.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.169 0.509 . . . . 0.0 109.701 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -115.26 157.78 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.343 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.81 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.2 OUTLIER 179.47 -159.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.528 178.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.81 ' N ' HG23 ' A' ' 92' ' ' ILE . 5.8 m-20 -134.47 113.89 12.31 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.863 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -9.23 58.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.486 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.626 ' C ' ' H ' ' A' ' 97' ' ' ASP . 0.1 OUTLIER -131.63 -56.26 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.588 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.452 ' H ' HG23 ' A' ' 95' ' ' THR . . . 65.2 -27.87 0.12 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.626 ' H ' ' C ' ' A' ' 95' ' ' THR . 0.0 OUTLIER 179.71 135.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.737 0.303 . . . . 0.0 110.49 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.13 86.45 2.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.46 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -19.64 22.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.102 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.67 -26.78 60.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.607 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.532 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 6.1 t70 -69.28 -54.11 16.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.421 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.63 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.6 OUTLIER -57.56 -47.87 80.88 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.145 0.497 . . . . 0.0 110.051 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 22.0 tt0 -44.98 -19.8 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.566 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.3 ttt180 -82.76 -37.86 24.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.768 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.63 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.9 -54.77 40.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.526 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -65.56 -36.41 77.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 121.371 0.605 . . . . 0.0 110.594 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -65.21 -40.9 94.77 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.44 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.806 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 6.4 tp -58.21 -45.97 86.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.408 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.9 OUTLIER -66.83 -55.88 12.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.277 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 110' ' ' LEU . 18.4 tp -47.62 -17.9 0.12 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.806 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -76.27 -58.29 3.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.597 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -49.9 -21.28 1.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.619 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -88.36 -52.83 4.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.868 179.402 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -43.86 -13.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.619 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -101.31 -40.67 7.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.838 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.485 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -75.88 -14.74 60.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.804 179.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.436 ' O ' ' C ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -66.65 -62.05 1.66 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.217 179.751 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.607 ' C ' ' H ' ' A' ' 120' ' ' THR . 9.9 mtp180 -36.36 -80.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 60.74 -6.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.462 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.607 ' H ' ' C ' ' A' ' 118' ' ' ARG . 26.6 p -41.01 136.74 1.41 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.55 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 135.64 80.97 0.12 Allowed Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.506 HG23 ' OG1' ' A' ' 123' ' ' THR . 11.9 tt -167.59 176.12 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 0.0 110.484 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.506 ' OG1' HG23 ' A' ' 122' ' ' ILE . 0.7 OUTLIER 53.22 50.11 18.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.585 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.36 118.95 9.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.423 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.48 -38.02 17.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.933 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.8 -35.34 69.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.882 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -81.62 -35.48 30.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.676 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 132' ' ' VAL . . . -71.09 -39.18 72.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.876 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.1 mm -78.0 -40.28 26.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.821 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.5 t -73.7 -22.02 60.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -56.9 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.583 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 128' ' ' ALA . 2.2 p -56.92 -37.54 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.596 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -63.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.456 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 134' ' ' GLU . 0.4 OUTLIER -45.63 -50.51 13.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.439 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.14 -42.52 66.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.675 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 6.6 m -70.26 -72.22 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.458 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.445 ' O ' ' HB3' ' A' ' 138' ' ' ALA . 2.0 pt -50.76 -22.66 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.372 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 137' ' ' ILE . . . 66.51 -162.76 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.526 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -90.34 93.89 9.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.521 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -148.69 114.48 5.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.281 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.681 ' O ' ' N ' ' A' ' 143' ' ' CYS . 2.7 mttp -98.52 -81.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.465 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.455 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . 35.58 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.562 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.681 ' N ' ' O ' ' A' ' 141' ' ' LYS . 0.7 OUTLIER -163.27 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.461 179.887 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.559 HD23 ' N ' ' A' ' 145' ' ' LYS . 0.9 OUTLIER -178.47 -3.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.376 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.559 ' N ' HD23 ' A' ' 144' ' ' LEU . 8.0 mtpp 57.98 -179.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.661 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.622 -179.943 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.562 ' O ' ' OG1' ' A' ' 2' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.619 ' C ' ' H ' ' A' ' 4' ' ' GLU . 20.3 p 60.98 89.66 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.646 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.655 ' O ' HG22 ' A' ' 3' ' ' VAL . 4.9 p -52.91 -0.1 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.964 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.619 ' H ' ' C ' ' A' ' 2' ' ' THR . 2.9 mm-40 -32.17 109.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.545 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.17 74.65 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.75 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -47.08 137.9 7.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.66 147.0 31.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.802 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -85.03 -5.64 59.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.329 179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.436 ' C ' ' H ' ' A' ' 11' ' ' SER . 25.0 tp60 -86.59 15.01 5.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.315 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.446 ' HG3' ' H ' ' A' ' 10' ' ' GLN . 4.6 pp0? -69.76 6.25 1.22 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.526 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.436 ' H ' ' C ' ' A' ' 9' ' ' GLN . 19.3 p -132.53 65.88 1.57 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.77 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.454 ' O ' ' N ' ' A' ' 14' ' ' GLN . . . -62.37 -23.02 66.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.294 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.42 -19.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.818 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 12' ' ' ALA . 1.8 mm100 -47.92 -42.31 26.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -84.51 -18.58 35.31 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.706 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.402 ' C ' ' N ' ' A' ' 18' ' ' GLN . 0.2 OUTLIER -88.17 -25.98 22.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.314 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.721 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 1.3 pm0 -45.13 -24.6 0.26 Allowed 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.215 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.662 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 77.4 mt-30 -53.82 -41.47 67.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.654 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -81.06 -44.78 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.148 0.499 . . . . 0.0 110.564 -179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.887 ' CD1' HD12 ' A' ' 40' ' ' LEU . 12.4 t80 -48.79 -60.68 2.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.84 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 37' ' ' GLN . 80.1 mt -58.58 -40.71 83.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.447 ' HB3' ' NE2' ' A' ' 23' ' ' GLN . 35.8 t-20 -54.18 -40.62 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.654 ' NE2' ' O ' ' A' ' 19' ' ' THR . 5.6 mm-40 -60.05 -52.96 63.15 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.623 HD21 ' HB1' ' A' ' 50' ' ' ALA . 10.4 mt -44.31 -22.4 0.07 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.208 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.444 ' N ' ' C ' ' A' ' 23' ' ' GLN . 19.3 ttm-85 -86.95 -27.2 23.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.257 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 23' ' ' GLN . 26.4 mt-10 -88.49 -55.75 3.59 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.414 1.265 . . . . 0.0 114.414 -177.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.52 -60.02 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.615 -176.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.576 HG21 HD22 ' A' ' 54' ' ' LEU . 0.4 OUTLIER -84.82 -4.52 59.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.693 -178.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.27 32.49 67.9 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.834 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.872 HD12 HD23 ' A' ' 54' ' ' LEU . 3.5 mt -98.96 145.47 10.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.77 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 33' ' ' THR . 15.0 m-20 -97.33 -44.46 6.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.51 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.82 88.45 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.554 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.575 ' N ' ' O ' ' A' ' 31' ' ' ASN . 19.1 p -60.92 -23.88 65.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.45 -44.75 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.05 0.453 . . . . 0.0 110.237 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.4 mt -73.87 -31.2 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.498 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.681 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.7 mt -70.59 -63.57 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.808 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.532 ' OE1' ' N ' ' A' ' 38' ' ' GLN . 0.0 OUTLIER -47.39 -35.48 8.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.103 0.478 . . . . 0.0 110.369 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 37' ' ' GLN . 2.3 tp-100 -73.34 -34.15 65.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.959 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.64 -44.56 95.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.683 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.887 HD12 ' CD1' ' A' ' 20' ' ' PHE . 3.2 tt -62.89 -44.46 96.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.952 0.406 . . . . 0.0 110.579 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.69 -33.55 66.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 m-20 -87.18 -23.35 24.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.888 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.666 ' O ' ' ND2' ' A' ' 46' ' ' ASN . 0.3 OUTLIER -88.96 -7.91 55.13 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.026 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 25.8 m-20 66.27 21.84 10.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.313 178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.47 14.54 27.56 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.731 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.666 ' ND2' ' O ' ' A' ' 43' ' ' SER . 1.5 m-80 -107.95 127.39 53.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.505 HD22 ' CZ ' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -68.78 -62.81 1.23 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.517 ' C ' HD22 ' A' ' 49' ' ' LEU . 50.5 mt-10 -44.54 -21.69 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.012 0.434 . . . . 0.0 110.702 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.948 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -90.22 -39.44 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.684 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.623 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -64.45 -50.89 65.74 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.697 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.6 p -59.63 -49.43 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.368 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.837 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -61.53 -33.94 74.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.528 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -59.11 -28.35 66.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.287 179.312 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 30' ' ' ILE . 7.7 mp -80.53 -55.11 5.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.436 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.546 ' O ' ' N ' ' A' ' 57' ' ' LYS . 3.1 t -87.76 -44.8 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.008 0.433 . . . . 0.0 110.126 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.837 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 26.68 -90.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.8 179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.546 ' N ' ' O ' ' A' ' 55' ' ' THR . 10.1 tptp 69.41 -61.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.308 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.419 ' N ' ' O ' ' A' ' 56' ' ' ALA . 70.0 m-80 -126.54 -22.08 4.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.063 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -90.27 83.39 5.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.655 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.64 ' O ' ' CB ' ' A' ' 61' ' ' THR . 15.8 tttt -81.43 -99.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.196 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.64 ' CB ' ' O ' ' A' ' 60' ' ' LYS . 1.3 m 93.65 76.52 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.251 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.519 ' C ' ' H ' ' A' ' 64' ' ' GLN . 53.7 Cg_endo -91.07 -126.7 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 123.375 2.716 . . . . 0.0 111.835 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.439 ' H ' ' HB2' ' A' ' 62' ' ' PRO . 11.6 tt0 70.1 -16.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.797 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 62' ' ' PRO . 1.8 tp60 -139.99 59.61 1.57 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.792 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.624 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -99.29 122.48 42.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.267 179.797 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.79 -176.13 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.489 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 69' ' ' TYR . 3.3 m -108.6 144.7 35.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.68 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.31 -53.7 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.444 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.43 ' H ' HG22 ' A' ' 67' ' ' THR . 58.9 t80 62.35 143.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.68 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.67 -159.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.281 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -109.15 -26.43 10.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.577 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.732 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 p -51.14 163.34 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.732 ' HB2' ' O ' ' A' ' 72' ' ' THR . . . 156.65 23.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.305 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' C ' ' O ' ' A' ' 73' ' ' ALA . 2.9 tp -27.24 93.93 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.499 ' N ' ' O ' ' A' ' 73' ' ' ALA . 50.4 Cg_exo -49.24 -18.75 2.25 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.686 2.257 . . . . 0.0 112.161 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.17 -153.38 37.56 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.525 ' OD1' ' C ' ' A' ' 77' ' ' ASN . 19.5 t-20 -173.6 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.87 0.367 . . . . 0.0 110.596 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -77.22 -174.7 3.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.54 ' C ' ' H ' ' A' ' 81' ' ' ILE . 6.2 mmm180 -84.89 -24.67 28.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.338 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER 70.27 -35.08 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.516 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.61 ' C ' ' H ' ' A' ' 83' ' ' VAL . 0.4 OUTLIER -128.77 143.21 41.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.349 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.465 ' O ' ' C ' ' A' ' 83' ' ' VAL . 1.4 m -67.03 19.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.61 ' H ' ' C ' ' A' ' 81' ' ' ILE . 11.8 m 32.73 38.53 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 82' ' ' SER . . . 68.81 87.34 0.09 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.13 23.9 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.238 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.528 ' O ' ' HB3' ' A' ' 87' ' ' ALA . 1.2 tp60 -57.57 -27.42 62.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.875 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . 70.31 170.4 0.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -118.73 -54.35 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.681 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.432 HG22 ' H ' ' A' ' 89' ' ' THR . 0.2 OUTLIER -45.84 140.9 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.61 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.462 ' OD1' ' O ' ' A' ' 90' ' ' ASN . 48.0 t-20 179.83 29.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.281 0.563 . . . . 0.0 109.742 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.3 m -98.23 164.84 2.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.214 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.803 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.3 OUTLIER 179.28 -161.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.932 178.86 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.803 ' N ' HG23 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -145.32 128.81 16.99 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.219 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.518 ' H ' HD12 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -128.3 12.15 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.827 -179.797 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.452 ' O ' ' C ' ' A' ' 96' ' ' GLY . 2.7 t -129.32 -15.65 4.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.452 ' C ' ' O ' ' A' ' 95' ' ' THR . . . -34.68 -67.9 0.25 Allowed Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.597 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -67.3 90.93 0.23 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.821 0.343 . . . . 0.0 110.433 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -53.98 147.32 12.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.711 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -91.62 -6.24 52.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.649 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -87.62 -31.26 19.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.765 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -48.97 -27.42 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.9 OUTLIER -77.19 -52.98 8.31 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.045 0.45 . . . . 0.0 110.669 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.424 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.3 mp0 -44.25 -18.82 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -85.97 -39.11 17.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.451 -1.249 . . . . 0.0 109.99 179.548 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -50.33 -57.39 8.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.521 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.514 ' H ' HD12 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -65.31 -54.68 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-O 121.566 0.698 . . . . 0.0 110.332 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.51 -60.23 1.83 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.51 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.465 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.4 OUTLIER -47.87 -40.11 20.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.3 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.497 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.1 OUTLIER -68.56 -45.33 72.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.473 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mp -48.46 -19.05 0.28 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.497 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.21 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.226 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -49.39 -19.61 0.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.016 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.559 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.3 OUTLIER -89.85 -52.35 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 179.614 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -47.56 -10.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.784 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.559 ' H ' ' C ' ' A' ' 113' ' ' SER . 10.2 mpt_? -106.15 -36.61 6.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.827 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.576 ' O ' ' O ' ' A' ' 117' ' ' PHE . . . -88.73 -7.44 56.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.122 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.576 ' O ' ' O ' ' A' ' 116' ' ' ALA . 50.6 t80 -43.16 178.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.715 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.552 ' N ' ' CG ' ' A' ' 117' ' ' PHE . 4.8 mtt180 -89.33 82.26 6.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.275 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.516 ' CD ' ' O ' ' A' ' 119' ' ' GLU . 0.5 OUTLIER -70.56 48.13 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.102 -179.481 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.5 t -53.69 171.49 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.001 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -171.99 -79.64 0.05 OUTLIER Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -150.89 143.62 16.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.92 0.391 . . . . 0.0 110.83 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.15 26.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.165 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 124' ' ' ASP . 0.6 OUTLIER -118.04 45.26 2.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.729 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -79.06 -35.22 42.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -53.53 45.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.453 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -64.51 -35.98 82.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.161 179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -59.22 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.175 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 129' ' ' ILE . 9.1 mm -35.76 -40.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.318 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 30.8 t -66.49 -69.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.497 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -42.15 -48.68 4.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.653 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 128' ' ' ALA . 13.7 t -57.22 -62.39 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.673 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.428 ' HA ' HD13 ' A' ' 133' ' ' LEU . 0.2 OUTLIER -41.38 -35.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.461 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -61.97 -49.05 77.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.535 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.07 -17.4 25.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.738 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.6 m -87.39 -50.41 6.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.499 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 8.6 tt -76.0 -13.24 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.488 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -96.25 4.15 52.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.697 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -96.3 103.1 14.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.449 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -144.84 63.86 1.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.87 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.56 117.02 18.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.23 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -112.58 -153.73 0.53 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.449 ' O ' ' SG ' ' A' ' 143' ' ' CYS . 47.2 t -157.83 32.82 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.384 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.965 HD23 ' O ' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -60.73 155.67 18.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.557 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER -150.6 13.11 0.73 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.285 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.634 HH11 ' CG ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.582 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ttt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.563 ' O ' ' N ' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -110.34 89.75 3.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 3' ' ' VAL . 9.4 p 35.63 28.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.838 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 2' ' ' THR . 2.9 mt-10 -119.18 -165.35 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.38 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.474 ' O ' HG23 ' A' ' 7' ' ' VAL . 0.0 OUTLIER 37.77 31.48 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.56 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.557 ' C ' ' H ' ' A' ' 8' ' ' LEU . 6.2 m-20 61.81 -88.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.456 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 5' ' ' GLN . 6.5 t 52.09 6.01 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.449 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.661 ' CD2' ' H ' ' A' ' 8' ' ' LEU . 0.9 OUTLIER -87.85 -0.57 57.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.656 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.454 ' N ' HD23 ' A' ' 8' ' ' LEU . 19.0 tt0 -83.37 50.46 1.77 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.71 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.524 ' OE1' ' HB3' ' A' ' 13' ' ' ALA . 19.6 pt20 -121.98 166.03 15.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.328 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.45 -44.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.12 -16.46 61.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.524 ' HB3' ' OE1' ' A' ' 10' ' ' GLN . . . -70.57 -21.41 62.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.623 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.84 69.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.733 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt -70.21 -19.15 63.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.609 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -82.11 -19.51 39.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.947 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.9 OUTLIER -45.7 -40.16 8.94 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.913 0.387 . . . . 0.0 110.18 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -43.74 -58.33 2.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.09 -179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.48 -34.43 67.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.451 0.643 . . . . 0.0 110.648 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.603 ' CE2' HD13 ' A' ' 40' ' ' LEU . 1.1 t80 -50.72 -60.61 2.87 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.273 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 17' ' ' GLN . 2.0 mt -66.24 -47.19 74.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.117 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -48.71 -42.75 36.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.144 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -63.16 -53.64 50.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.001 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.645 ' HA ' HD11 ' A' ' 27' ' ' ILE . 26.4 mt -47.91 -26.1 1.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.4 ttm105 -85.38 -19.14 31.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.447 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 23' ' ' GLN . 7.0 tt0 -86.6 -58.53 2.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.859 HD13 ' H ' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -67.24 -54.8 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.548 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.609 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.3 t -87.75 -2.57 58.7 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.588 -176.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 60.83 4.66 4.48 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.622 -0.717 . . . . 0.0 113.67 177.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.573 HG22 ' H ' ' A' ' 32' ' ' ASP . 40.8 mm -65.99 125.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 118.077 0.939 . . . . 0.0 109.961 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -105.57 30.78 5.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.234 -179.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.573 ' H ' HG22 ' A' ' 30' ' ' ILE . 14.9 m-20 -100.7 88.85 3.71 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.4 m -53.84 -30.41 45.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.895 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -67.7 -51.89 44.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.498 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.81 -22.25 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.566 HD12 HD21 ' A' ' 54' ' ' LEU . 0.7 OUTLIER -73.71 -63.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.584 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -51.8 -27.53 12.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -73.82 -25.27 60.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.456 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.481 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -73.97 -35.37 64.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.006 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.603 HD13 ' CE2' ' A' ' 20' ' ' PHE . 14.1 tp -67.36 -47.75 69.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.399 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -59.78 -41.78 91.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.359 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.471 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -86.34 -15.65 39.85 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.116 -179.391 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.661 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -76.8 -31.21 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.483 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.571 ' OD1' ' O ' ' A' ' 43' ' ' SER . 0.5 OUTLIER 84.51 13.51 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.931 -179.529 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.21 13.37 31.26 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.112 -0.565 . . . . 0.0 112.388 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.781 ' HB2' HD22 ' A' ' 49' ' ' LEU . 10.0 m120 -107.92 130.67 55.01 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' A' ' 50' ' ' ALA . 53.7 tp -86.02 -64.76 1.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -177.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -46.44 -26.33 0.83 Allowed 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.678 0.751 . . . . 0.0 109.276 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -87.19 -29.85 21.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.387 179.322 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.838 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -74.26 -58.37 3.34 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' N ' ' A' ' 52' ' ' ALA . 14.5 p -43.63 -40.07 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.796 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -67.64 -27.89 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.252 -1.34 . . . . 0.0 110.392 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.696 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -60.0 -28.92 68.1 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.452 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.803 ' N ' HD12 ' A' ' 54' ' ' LEU . 5.6 mp -80.62 -53.51 6.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.299 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.61 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -86.8 -47.79 8.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.025 179.46 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.796 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 30.58 104.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.092 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.664 ' O ' ' N ' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -69.36 -174.1 0.63 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.172 -179.71 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.706 ' ND2' ' O ' ' A' ' 65' ' ' GLU . 20.8 t-20 38.81 16.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.075 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.664 ' N ' ' O ' ' A' ' 57' ' ' LYS . . . 60.77 -73.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.333 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.577 ' N ' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -117.21 -72.47 0.69 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.144 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.561 ' N ' ' CD ' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -175.7 -47.07 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 C-N-CA 120.801 -0.359 . . . . 0.0 111.11 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 61' ' ' THR . 50.0 Cg_endo -87.93 32.67 0.41 Allowed 'Trans proline' 0 C--N 1.304 -1.805 0 C-N-CA 123.186 2.591 . . . . 0.0 112.205 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.473 ' O ' ' N ' ' A' ' 65' ' ' GLU . 3.9 tt0 -102.03 -156.28 0.55 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.279 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.444 ' O ' ' C ' ' A' ' 65' ' ' GLU . 3.8 mp0 -67.08 60.02 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.444 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.706 ' O ' ' ND2' ' A' ' 58' ' ' ASN . 4.7 mt-10 36.95 -130.3 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.544 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -132.68 23.25 4.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.466 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 68' ' ' THR . 4.4 m 70.97 -128.41 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.645 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.469 ' H ' HG22 ' A' ' 67' ' ' THR . 27.8 p -141.16 -52.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.709 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.455 ' CD2' ' O ' ' A' ' 68' ' ' THR . 15.8 m-85 -163.75 160.86 23.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.704 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.664 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -116.61 -165.03 1.02 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -122.63 104.04 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.555 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 79.8 p -123.67 -26.07 4.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.53 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.475 ' O ' ' C ' ' A' ' 74' ' ' LEU . . . -91.26 -151.46 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.537 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' A' ' 73' ' ' ALA . 3.2 tp 34.03 91.95 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.568 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -81.47 -3.84 12.12 Favored 'Trans proline' 0 C--N 1.306 -1.658 0 C-N-CA 122.795 2.33 . . . . 0.0 111.985 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.6 -0.24 42.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.514 ' O ' ' ND2' ' A' ' 77' ' ' ASN . 0.8 OUTLIER 47.8 53.1 11.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.799 0.333 . . . . 0.0 110.57 179.875 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.77 169.27 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.462 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.476 ' CG ' ' N ' ' A' ' 80' ' ' TYR . 45.0 ttp180 -155.01 160.35 41.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.591 ' O ' ' C ' ' A' ' 81' ' ' ILE . 0.2 OUTLIER -116.04 -171.86 2.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.429 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.591 ' C ' ' O ' ' A' ' 80' ' ' TYR . 0.2 OUTLIER 16.04 76.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.198 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.7 p -98.42 -31.87 11.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.549 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 15.4 t -83.04 66.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.684 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.506 ' O ' ' C ' ' A' ' 85' ' ' SER . . . -60.32 -44.94 97.0 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.756 -0.937 . . . . 0.0 110.756 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 84' ' ' GLY . 4.8 p 30.66 50.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.786 0.327 . . . . 0.0 110.674 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -76.12 -171.09 1.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.466 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.39 131.56 52.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.553 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -131.82 33.83 3.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.559 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.2 t -135.63 125.53 25.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.409 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.534 ' O ' ' CG ' ' A' ' 90' ' ' ASN . 15.7 t30 -169.67 25.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.298 0.571 . . . . 0.0 109.691 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.48 153.88 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.037 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.804 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.8 OUTLIER -179.8 -159.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.634 178.945 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.804 ' N ' HG23 ' A' ' 92' ' ' ILE . 1.2 p30 -116.34 136.31 53.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.501 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -94.62 -5.96 44.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.64 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.481 HG23 ' H ' ' A' ' 96' ' ' GLY . 0.1 OUTLIER -116.37 -57.48 2.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.679 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.481 ' H ' HG23 ' A' ' 95' ' ' THR . . . 102.69 11.61 34.78 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -179.56 145.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.841 0.353 . . . . 0.0 110.425 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -69.13 154.81 41.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.466 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' C ' ' N ' ' A' ' 101' ' ' ASP . 7.2 mmmt -86.29 -5.93 59.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.613 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.502 ' OD1' ' N ' ' A' ' 101' ' ' ASP . 60.1 p30 -49.33 -17.64 0.28 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.502 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 12.3 m-20 -55.31 -23.5 23.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.605 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.866 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.2 pp -56.03 -46.11 78.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.086 0.469 . . . . 0.0 110.16 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.866 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.14 -19.71 0.08 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.528 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.534 ' N ' ' C ' ' A' ' 102' ' ' LEU . 20.8 ttp85 -85.09 -37.04 20.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.968 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -62.95 -45.3 93.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.314 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.819 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -69.44 -32.66 53.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-O 121.236 0.541 . . . . 0.0 110.537 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.36 -60.29 3.58 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.237 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 30.7 mt -47.24 -42.58 20.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.521 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.454 ' C ' ' N ' ' A' ' 111' ' ' ALA . 81.2 p -72.69 -41.77 64.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.661 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 mt -48.2 -19.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.454 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -89.44 -58.59 2.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.24 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -48.21 -21.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.563 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.659 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.2 OUTLIER -89.65 -46.85 8.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.879 179.289 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.515 ' OD1' ' O ' ' A' ' 114' ' ' ASN . 15.6 t-20 -39.01 -20.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.659 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -107.21 -40.39 5.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.199 179.379 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.438 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -95.61 23.09 6.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.504 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.536 ' N ' ' O ' ' A' ' 113' ' ' SER . 12.8 t80 -83.34 -78.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.659 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -49.66 -37.13 27.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.587 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 59.88 42.91 15.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.52 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.409 ' H ' HG22 ' A' ' 120' ' ' THR . 2.2 t -88.18 172.72 9.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.622 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 83.52 16.67 68.04 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 8.3 tp -59.3 148.13 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.75 0.31 . . . . 0.0 110.496 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 65.6 p -126.26 106.62 9.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -84.11 125.02 31.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.484 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 0.3 OUTLIER -48.7 -54.69 13.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.869 -179.876 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -51.24 -48.74 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.7 -25.89 67.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.774 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -66.45 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.75 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.653 ' H ' HD12 ' A' ' 129' ' ' ILE . 2.6 mp -49.35 -33.07 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.845 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' CB ' ' A' ' 134' ' ' GLU . 0.0 OUTLIER -68.73 -25.3 64.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.747 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.5 mmm180 -85.26 -49.59 8.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -54.98 -40.99 56.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.503 ' N ' ' CG1' ' A' ' 132' ' ' VAL . 4.1 tp -80.55 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.544 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 130' ' ' SER . 1.4 tt0 -38.0 -31.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.362 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . -78.62 -52.5 8.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.57 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -40.78 25.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.26 -62.22 2.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.597 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . 59.82 162.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.47 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -119.81 64.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.627 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.414 ' OD1' ' N ' ' A' ' 140' ' ' ASN . 1.6 m120 -92.25 -10.67 37.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.429 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.584 ' NZ ' ' SG ' ' A' ' 143' ' ' CYS . 19.9 tttm -94.47 126.29 39.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.726 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -123.76 104.67 9.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.485 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.584 ' SG ' ' NZ ' ' A' ' 141' ' ' LYS . 58.2 m -62.67 151.29 38.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.648 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.476 HD22 ' N ' ' A' ' 144' ' ' LEU . 4.5 mm? -84.96 91.99 8.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.566 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -40.3 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.505 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.416 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.563 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.579 ' O ' ' N ' ' A' ' 4' ' ' GLU . 4.2 m -92.61 -73.3 0.56 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.436 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.6 ' O ' HG22 ' A' ' 3' ' ' VAL . 3.4 p -57.1 75.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.734 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 2' ' ' THR . 1.6 mt-10 -129.2 148.55 51.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.74 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.545 ' O ' ' C ' ' A' ' 6' ' ' ASN . 2.5 tt0 -151.83 -55.44 0.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.355 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.545 ' C ' ' O ' ' A' ' 5' ' ' GLN . 14.2 p-10 26.96 56.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.801 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -43.94 135.02 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.298 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 57.7 tp -161.34 135.28 6.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.669 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -93.6 108.94 20.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.109 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.584 ' O ' ' CB ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -124.81 -171.83 2.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.765 -179.667 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.584 ' CB ' ' O ' ' A' ' 10' ' ' GLN . 1.8 t 88.62 -147.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.725 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.5 -15.6 63.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.57 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.39 -20.88 66.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.766 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -50.72 -19.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.919 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 -18.78 33.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.371 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -50.63 -33.34 21.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.295 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.495 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 2.5 mp0 -45.65 -29.67 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.728 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.65 ' N ' ' OE1' ' A' ' 18' ' ' GLN . 3.8 mp0 -61.52 -58.28 8.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.663 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.494 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -73.78 -34.92 64.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.446 0.641 . . . . 0.0 110.213 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' HD23 ' A' ' 40' ' ' LEU . 2.1 t80 -51.89 -60.77 2.79 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.91 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.9 mt -67.72 -31.99 72.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.983 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -60.11 -41.87 93.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 0.0 110.147 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.602 ' N ' ' OE1' ' A' ' 23' ' ' GLN . 1.3 mp0 -67.32 -50.18 61.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.109 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD22 ' A' ' 36' ' ' LEU . 12.6 mt -45.57 -31.82 2.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.33 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.1 ttt-85 -87.61 -20.62 26.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.908 0.385 . . . . 0.0 110.492 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.541 ' OE2' ' O ' ' A' ' 65' ' ' GLU . 2.1 tt0 -87.58 -58.08 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.553 HD13 ' H ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -62.76 -44.59 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.196 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.553 ' H ' HD13 ' A' ' 27' ' ' ILE . 1.4 t -99.64 -2.68 34.89 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.676 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 63.65 19.33 62.62 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.453 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.525 ' HB ' HD21 ' A' ' 36' ' ' LEU . 7.1 mm -79.12 113.56 18.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.541 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -76.75 -50.77 12.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.788 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.7 m-20 -41.43 103.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.308 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.6 t -71.76 -27.22 62.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.737 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -59.64 -41.71 91.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.518 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.403 HG22 ' CD1' ' A' ' 54' ' ' LEU . 12.8 mm -68.38 -45.84 81.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.705 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.833 HD22 ' HB3' ' A' ' 24' ' ' LEU . 18.2 mt -63.98 -60.75 2.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.189 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 36' ' ' LEU . 4.9 mm-40 -43.46 -29.2 0.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.421 ' N ' ' C ' ' A' ' 36' ' ' LEU . 10.8 tt0 -78.87 -32.28 45.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.083 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -69.64 -33.79 73.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.796 ' C ' HD13 ' A' ' 40' ' ' LEU . 3.0 tm? -66.12 -38.28 87.79 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.093 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -71.13 -42.61 68.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.97 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.56 -24.13 25.57 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.861 0.363 . . . . 0.0 111.481 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.593 ' OG ' ' O ' ' A' ' 39' ' ' ALA . 6.9 p -62.82 -30.3 71.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.778 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.2 t-20 83.66 14.28 0.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.01 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.84 4.97 48.24 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.06 -0.59 . . . . 0.0 111.642 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.62 ' CB ' HD22 ' A' ' 49' ' ' LEU . 2.9 m120 -100.74 130.16 46.74 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.655 ' O ' ' N ' ' A' ' 50' ' ' ALA . 2.1 tt -85.75 -62.84 1.43 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.879 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.522 ' O ' HG13 ' A' ' 51' ' ' VAL . 3.5 mt-10 -41.4 -38.21 1.19 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.093 0.473 . . . . 0.0 110.393 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.959 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -81.13 -26.56 36.04 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.235 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.959 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -69.63 -58.46 3.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 52' ' ' ALA . 1.6 p -44.41 -44.96 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.74 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 177.339 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.746 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -61.73 -28.62 69.55 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.282 -1.781 . . . . 0.0 110.361 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.641 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -64.32 -29.51 70.59 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.509 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 54' ' ' LEU . 3.1 mm? -75.66 -57.59 3.79 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.287 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.609 ' O ' ' CD ' ' A' ' 57' ' ' LYS . 3.1 t -89.84 -44.86 9.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.683 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.746 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 42.9 47.52 4.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.564 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.609 ' CD ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -169.92 -56.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.349 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 59' ' ' ALA . 15.7 t-20 -178.9 120.72 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.634 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 176.53 121.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.452 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.531 ' HG2' ' N ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -141.0 -171.3 3.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.375 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 61' ' ' THR . 1.3 m 169.71 91.86 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.166 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.563 ' O ' ' N ' ' A' ' 64' ' ' GLN . 93.4 Cg_endo -90.63 -16.14 1.64 Allowed 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.156 2.571 . . . . 0.0 112.119 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.59 ' O ' ' C ' ' A' ' 64' ' ' GLN . 7.0 tt0 -29.91 92.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.269 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.59 ' C ' ' O ' ' A' ' 63' ' ' GLN . 5.1 mm-40 -15.18 89.41 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.464 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.541 ' O ' ' OE2' ' A' ' 26' ' ' GLU . 18.8 tt0 -130.76 120.8 24.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.564 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -163.24 -64.93 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.397 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.4 t -177.49 -16.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.723 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.662 HG22 ' H ' ' A' ' 69' ' ' TYR . 7.5 m 66.8 -131.26 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.656 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.662 ' H ' HG22 ' A' ' 68' ' ' THR . 58.5 m-85 57.3 170.97 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.672 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -78.98 -150.74 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.593 ' C ' ' H ' ' A' ' 73' ' ' ALA . 2.0 tm0? -109.79 -63.0 1.42 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.484 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.521 ' O ' HG22 ' A' ' 72' ' ' THR . 88.9 m 60.12 -7.53 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.08 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 71' ' ' GLN . . . 36.26 -157.63 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.546 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.3 tp -52.86 112.65 3.7 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.669 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -46.96 -28.06 6.66 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.295 1.997 . . . . 0.0 112.036 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.542 ' O ' ' C ' ' A' ' 77' ' ' ASN . . . 61.81 -170.33 10.79 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.572 ' ND2' ' O ' ' A' ' 77' ' ' ASN . 3.7 p-10 28.7 67.92 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.764 0.316 . . . . 0.0 110.512 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.471 ' CG ' ' O ' ' A' ' 78' ' ' ASP . 7.2 p-10 -160.92 103.5 1.31 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.882 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.465 ' HE ' ' HB ' ' A' ' 83' ' ' VAL . 19.5 ttp180 -124.54 15.09 8.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.232 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 64.66 -51.82 0.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.524 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.661 HG22 ' H ' ' A' ' 82' ' ' SER . 10.4 mt -105.09 171.89 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.907 0.384 . . . . 0.0 111.044 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.661 ' H ' HG22 ' A' ' 81' ' ' ILE . 2.5 m -41.83 138.43 1.48 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.627 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.575 ' O ' HG22 ' A' ' 83' ' ' VAL . 8.4 p -158.38 63.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.575 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.01 -50.45 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 59.95 76.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.696 0.284 . . . . 0.0 110.647 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -79.81 -92.14 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.57 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -170.43 -175.27 1.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.465 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 89' ' ' THR . 3.6 t0 -150.2 -36.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.457 ' O ' ' O ' ' A' ' 88' ' ' ASP . 23.9 m 57.56 116.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.196 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -174.08 32.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.13 0.49 . . . . 0.0 109.828 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.5 161.18 3.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.134 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.814 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.9 tt -179.79 -160.58 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.816 179.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.814 ' N ' HG23 ' A' ' 92' ' ' ILE . 68.9 m-20 -54.47 -43.43 71.72 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.687 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.62 ' H ' HG23 ' A' ' 92' ' ' ILE . 0.6 OUTLIER 81.79 -53.81 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.383 -179.858 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.495 ' O ' ' C ' ' A' ' 96' ' ' GLY . 3.1 t -74.75 -36.04 62.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.215 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.495 ' C ' ' O ' ' A' ' 95' ' ' THR . . . 31.08 47.28 0.17 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -87.96 150.51 23.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.69 0.281 . . . . 0.0 110.381 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -106.06 86.18 2.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -79.65 -47.51 15.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.178 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -37.12 39.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.973 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -80.33 -21.87 42.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.262 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.642 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.8 OUTLIER -64.86 -52.92 54.02 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.064 0.459 . . . . 0.0 110.325 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.406 ' C ' ' O ' ' A' ' 102' ' ' LEU . 3.9 mm-40 -44.67 -18.33 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.583 ' N ' ' C ' ' A' ' 102' ' ' LEU . 13.5 tpp180 -84.54 -35.5 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.873 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.642 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.91 -40.71 94.19 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.481 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -67.75 -40.32 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.611 0.72 . . . . 0.0 109.772 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.91 75.28 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.214 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.8 OUTLIER -58.84 -41.05 86.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.133 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.458 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.3 m -72.91 -47.89 41.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.225 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.43 -18.58 0.24 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.458 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -84.99 -52.86 5.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.274 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -47.12 -20.96 0.19 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.519 . . . . 0.0 109.74 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.568 ' C ' ' H ' ' A' ' 115' ' ' ARG . 20.1 m -87.42 -54.03 4.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.039 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -48.35 -11.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.568 ' H ' ' C ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -94.82 -42.23 8.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.055 178.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -83.68 20.24 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.529 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.49 171.24 19.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.427 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.627 ' C ' ' H ' ' A' ' 120' ' ' THR . 9.8 ptt85 175.1 -50.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.949 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 45.97 6.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.018 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.627 ' H ' ' C ' ' A' ' 118' ' ' ARG . 45.1 p -48.1 -53.0 18.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.404 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 78.95 93.25 0.32 Allowed Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 6.3 mt -147.93 127.27 4.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.475 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.0 156.25 39.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.447 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -109.38 -38.25 5.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.477 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE2' ' OE1' ' A' ' 126' ' ' GLU . 1.0 OUTLIER -49.95 -32.72 15.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.474 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.568 ' OE1' ' OE2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -60.89 -31.59 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.988 0.423 . . . . 0.0 110.177 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.43 -37.41 65.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.458 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.06 -65.8 0.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.2 pt -46.68 -32.84 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.411 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -63.02 -37.98 89.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.638 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -65.76 -39.38 91.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.8 t -57.73 -57.69 9.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.635 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.0 mp -48.77 -59.45 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.691 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -52.53 -58.48 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -51.23 -32.49 24.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.85 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 5.7 p -92.26 -5.23 52.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.86 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -113.45 -72.76 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.462 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.598 ' O ' ' O ' ' A' ' 139' ' ' GLU . . . 59.77 98.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.654 ' CG ' ' H ' ' A' ' 140' ' ' ASN . 1.1 tp10 13.44 -134.47 0.0 OUTLIER 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.746 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.654 ' H ' ' CG ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER 160.29 -169.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.633 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 140' ' ' ASN . 0.0 OUTLIER 33.59 66.7 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.783 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.657 ' O ' ' SG ' ' A' ' 143' ' ' CYS . . . -50.31 -23.77 2.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.527 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.657 ' SG ' ' O ' ' A' ' 142' ' ' ALA . 1.3 m 155.89 -172.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.614 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.809 HD23 ' N ' ' A' ' 144' ' ' LEU . 1.8 pt? -165.57 42.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -109.07 115.08 29.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.565 ' OXT' ' CG ' ' A' ' 146' ' ' ARG . 21.2 ptt180 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.463 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.586 ' C ' ' H ' ' A' ' 4' ' ' GLU . 2.2 t -154.01 79.85 1.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.562 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.549 ' O ' HG22 ' A' ' 3' ' ' VAL . 7.3 p -48.23 -6.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.811 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.586 ' H ' ' C ' ' A' ' 2' ' ' THR . 20.7 tt0 176.3 130.98 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.653 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.435 ' HG2' ' H ' ' A' ' 6' ' ' ASN . 4.4 tt0 -118.6 -157.34 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.373 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.505 ' O ' HG13 ' A' ' 7' ' ' VAL . 3.0 m120 62.98 -127.36 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.22 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.598 ' O ' ' O ' ' A' ' 8' ' ' LEU . 11.1 m -156.06 -46.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.496 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.598 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.2 OUTLIER 23.76 103.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.034 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.86 59.8 3.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.699 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.606 ' O ' ' N ' ' A' ' 12' ' ' ALA . 3.3 pt20 -74.95 135.77 41.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.511 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.7 t -60.11 68.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.624 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.606 ' N ' ' O ' ' A' ' 10' ' ' GLN . . . -53.71 -17.65 2.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.636 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.525 ' O ' ' OE1' ' A' ' 17' ' ' GLN . . . -73.42 -30.33 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.626 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.461 ' HA ' ' NE2' ' A' ' 17' ' ' GLN . 0.2 OUTLIER -57.62 -26.91 62.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 tmtm? -85.44 -18.62 33.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.667 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -22.18 38.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.516 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -50.72 -25.86 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.717 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -58.61 7.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.794 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -73.75 -41.26 62.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.334 0.588 . . . . 0.0 110.381 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.625 ' CE1' HD23 ' A' ' 40' ' ' LEU . 19.4 t80 -50.53 -61.02 2.44 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.142 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.674 HD21 ' HA ' ' A' ' 37' ' ' GLN . 17.8 mt -59.25 -49.93 75.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.145 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -44.74 -41.21 6.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.665 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -65.17 -52.48 54.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.866 179.025 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.747 HD21 ' HB1' ' A' ' 50' ' ' ALA . 11.2 mt -43.66 -28.07 0.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.824 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.36 -23.12 24.68 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.131 0.491 . . . . 0.0 109.742 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.665 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -88.02 -56.69 3.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.016 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.14 -59.53 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 121.016 0.436 . . . . 0.0 111.741 -176.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.837 ' OG1' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -81.35 -13.53 58.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.24 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.36 31.97 82.12 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.837 HD13 ' OG1' ' A' ' 28' ' ' THR . 0.4 OUTLIER -90.07 152.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.913 0.387 . . . . 0.0 110.532 -179.065 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 33' ' ' THR . 19.0 t-20 -105.15 -39.38 6.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.746 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB3' HD12 ' A' ' 35' ' ' ILE . 7.2 m-20 -48.75 85.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.21 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.587 ' N ' ' O ' ' A' ' 31' ' ' ASN . 18.0 p -60.8 -20.21 61.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.012 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -66.99 -49.61 64.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 110.971 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' HB3' ' A' ' 32' ' ' ASP . 3.3 mt -63.82 -31.23 52.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.137 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.638 ' CD2' HD21 ' A' ' 54' ' ' LEU . 8.8 mt -63.59 -61.78 2.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.758 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.674 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -48.7 -27.24 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.245 0.545 . . . . 0.0 109.59 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.491 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 16.4 mt-30 -80.4 -37.95 31.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.372 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.76 97.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.114 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.901 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -62.54 -42.29 99.43 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.713 ' N ' HD13 ' A' ' 40' ' ' LEU . 1.9 mmtp -52.22 -33.39 41.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.908 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.506 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.5 OUTLIER -86.74 -43.87 12.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.599 179.559 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.599 ' HG ' ' HZ ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -65.63 -29.54 70.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.466 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 43' ' ' SER . 4.4 p30 48.65 53.16 12.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.056 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.38 -9.42 57.49 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.547 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.562 ' O ' ' OG ' ' A' ' 43' ' ' SER . 4.9 m120 -96.0 116.39 28.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.007 0.404 . . . . 0.0 110.198 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -77.41 -63.82 1.29 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.476 -178.492 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.502 ' C ' HD22 ' A' ' 49' ' ' LEU . 24.9 tt0 -42.88 -20.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.743 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.6 mm? -87.69 -52.48 5.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.713 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.747 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -51.1 -47.15 62.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.949 HG13 ' H ' ' A' ' 52' ' ' ALA . 6.5 p -63.21 -62.66 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 CA-C-O 121.517 0.675 . . . . 0.0 109.219 178.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.949 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -47.36 -27.42 1.62 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.236 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -65.74 -38.02 88.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.081 178.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 36' ' ' LEU . 7.8 mp -69.8 -56.65 6.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.261 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.594 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -80.85 -50.37 9.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.052 179.638 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.835 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 27.21 103.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.166 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -86.62 105.51 16.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.55 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.473 ' O ' ' C ' ' A' ' 59' ' ' ALA . 51.0 t30 69.25 -60.18 0.47 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.404 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.473 ' C ' ' O ' ' A' ' 58' ' ' ASN . . . -34.22 139.25 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.611 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.511 ' C ' ' OG1' ' A' ' 61' ' ' THR . 11.9 tttm -162.15 137.31 7.17 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.736 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.511 ' OG1' ' C ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER 173.84 70.64 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.218 0 CA-C-O 121.045 0.45 . . . . 0.0 110.658 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.451 ' HG3' ' HZ1' ' A' ' 60' ' ' LYS . 73.9 Cg_endo -92.17 -98.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 123.406 2.737 . . . . 0.0 112.389 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.68 ' O ' ' N ' ' A' ' 65' ' ' GLU . 19.2 tm0? 72.0 145.85 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.2 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -56.14 69.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.473 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.68 ' N ' ' O ' ' A' ' 63' ' ' GLN . 3.6 tt0 -73.43 133.68 43.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 65' ' ' GLU . 2.8 mp0 -59.61 -152.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.463 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.609 ' OG1' ' N ' ' A' ' 68' ' ' THR . 0.2 OUTLIER -124.91 -93.12 0.5 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.692 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.609 ' N ' ' OG1' ' A' ' 67' ' ' THR . 25.5 m 65.19 104.58 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.302 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.633 ' N ' ' CD1' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -104.21 -177.73 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.751 -179.72 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.469 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -82.1 -169.31 2.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.602 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -102.4 -178.86 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.703 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 0.2 OUTLIER -112.86 -165.97 1.04 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.425 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 72' ' ' THR . . . 162.06 137.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.415 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.858 HD23 ' O ' ' A' ' 74' ' ' LEU . 0.7 OUTLIER -65.36 124.84 88.17 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.736 -179.824 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -41.05 -45.89 5.17 Favored 'Trans proline' 0 C--N 1.312 -1.378 0 C-N-CA 122.397 2.065 . . . . 0.0 112.08 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 51.15 93.75 0.01 OUTLIER Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 78' ' ' ASP . 73.3 m-20 -141.59 -114.99 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.942 0.401 . . . . 0.0 110.662 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.53 ' C ' ' O ' ' A' ' 77' ' ' ASN . 4.2 p-10 27.76 84.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -86.91 -78.92 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.096 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 62.48 159.89 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.1 0.476 . . . . 0.0 111.045 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.6 mt 70.99 105.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.657 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.07 166.39 24.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.569 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 28.7 m -144.26 150.55 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.48 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.95 -74.54 0.54 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 70.59 10.77 7.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.85 0.357 . . . . 0.0 110.344 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -125.91 164.03 21.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.574 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 54.35 45.39 27.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.33 20.6 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.71 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.8 m -52.9 145.61 12.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.53 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -161.27 36.6 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.4 ' C ' HG22 ' A' ' 92' ' ' ILE . 0.3 OUTLIER -130.86 171.54 17.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.988 -179.182 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.63 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 2.7 tt 171.4 163.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.904 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.63 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 2.3 m-20 47.37 -176.85 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.281 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.574 ' C ' HD12 ' A' ' 94' ' ' LEU . 2.9 pp -149.93 -6.86 0.32 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.19 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.615 ' C ' ' H ' ' A' ' 97' ' ' ASP . 10.1 t -87.53 -33.04 19.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.357 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.45 ' O ' ' CB ' ' A' ' 97' ' ' ASP . . . 57.13 -4.3 0.05 OUTLIER Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.615 ' H ' ' C ' ' A' ' 95' ' ' THR . 1.3 p30 165.01 145.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.667 0.27 . . . . 0.0 110.616 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.7 151.12 30.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.652 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.572 ' HZ3' ' CB ' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -88.76 1.97 54.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.592 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 100' ' ' ASP . 12.8 t0 -71.84 -15.91 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.22 -57.35 13.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.789 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 105' ' ' ALA . 3.0 pp -69.03 -42.09 76.82 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.423 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.582 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.0 tp60 -50.4 -19.38 0.83 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.507 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.1 ttm180 -86.27 -32.65 20.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.398 -1.273 . . . . 0.0 110.003 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -56.47 -56.84 16.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.427 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.678 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.6 OUTLIER -77.53 -33.61 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.318 -179.217 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.59 -59.87 4.32 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.283 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.872 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.8 tp -53.83 -35.68 61.72 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.15 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.514 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.6 t -64.27 -52.62 57.71 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -48.12 -18.58 0.21 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.872 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -72.67 -53.92 10.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.817 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 112' ' ' GLU . 6.3 mm-40 -46.51 -23.08 0.33 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.486 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -86.15 -44.19 12.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.88 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.466 ' ND2' ' HD2' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -53.62 -9.7 0.22 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.294 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.486 ' H ' ' C ' ' A' ' 113' ' ' SER . 2.1 mpt_? -101.61 -46.31 5.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.823 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.59 -7.48 20.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.862 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -154.58 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.252 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.63 ' O ' ' N ' ' A' ' 120' ' ' THR . 37.8 mtt180 57.38 29.85 17.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.44 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.2 72.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.63 ' N ' ' O ' ' A' ' 118' ' ' ARG . 3.8 t -56.48 107.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.277 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -100.71 134.43 11.69 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.588 ' O ' ' CB ' ' A' ' 123' ' ' THR . 0.5 OUTLIER -60.65 -26.53 38.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.785 0.326 . . . . 0.0 110.563 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 124' ' ' ASP . 1.6 m 89.59 -142.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.56 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.615 ' H ' HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER 50.79 11.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.443 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.472 ' H ' ' C ' ' A' ' 123' ' ' THR . 2.8 tp10 -58.74 -40.45 83.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.627 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -59.02 -37.98 78.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.601 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -73.36 -38.16 65.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.511 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.35 -54.62 43.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.688 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.427 HG13 ' N ' ' A' ' 130' ' ' SER . 31.7 pt -59.39 -36.32 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.6 m -63.38 -74.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.502 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 130' ' ' SER . 2.3 tpp180 -33.8 -65.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.387 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 133' ' ' LEU . 79.5 t -39.48 -61.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.526 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.456 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER -35.53 -51.74 0.64 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.514 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.567 ' C ' ' H ' ' A' ' 136' ' ' SER . 48.6 mt-10 -63.55 -64.68 0.83 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.579 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.59 9.49 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.721 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.567 ' H ' ' C ' ' A' ' 134' ' ' GLU . 13.5 t -126.17 -11.25 6.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.635 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.558 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.2 tt -108.37 -12.16 10.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.421 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 139' ' ' GLU . . . -45.04 -13.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.612 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 137' ' ' ILE . 4.1 tt0 -31.54 -57.7 0.27 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.604 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -116.4 132.55 56.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.722 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -178.2 146.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.369 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -125.75 122.18 35.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.767 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.54 94.7 3.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.346 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.78 144.78 37.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -167.24 86.68 0.27 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.477 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.633 -179.972 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.43 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.503 ' O ' ' C ' ' A' ' 3' ' ' VAL . 55.1 m -85.28 -78.71 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.731 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.503 ' C ' ' O ' ' A' ' 2' ' ' THR . 1.3 m -29.84 133.54 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.5 ' O ' ' C ' ' A' ' 5' ' ' GLN . 7.8 tt0 -173.79 119.82 0.29 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.5 ' C ' ' O ' ' A' ' 4' ' ' GLU . 5.5 mm100 -30.6 133.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.894 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -84.27 108.95 17.42 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.673 ' C ' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -136.12 168.05 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.401 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.035 ' N ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -111.08 -15.86 13.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.923 0.392 . . . . 0.0 110.257 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -87.48 145.17 26.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.138 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.413 ' OE1' ' N ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER 59.29 16.96 5.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.225 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 85.7 p -67.9 74.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.776 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.79 -53.92 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.64 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -57.05 3.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -48.98 -18.29 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.672 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -24.83 59.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -58.39 -40.73 83.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.164 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -49.87 -41.49 45.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.26 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -45.56 -58.37 3.45 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.912 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -58.92 -48.15 82.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.058 0.456 . . . . 0.0 111.312 -179.222 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.518 ' N ' ' CG2' ' A' ' 19' ' ' THR . 22.8 t80 -49.3 -59.0 4.09 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.953 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.446 HD13 ' NE2' ' A' ' 37' ' ' GLN . 21.2 mt -61.8 -39.43 91.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.029 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.666 ' OD1' ' NH2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -53.41 -40.81 65.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.926 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.647 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.6 mt-30 -59.58 -52.08 67.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.575 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.737 HD11 ' HB1' ' A' ' 50' ' ' ALA . 9.9 mt -44.35 -36.58 2.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.588 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.666 ' NH2' ' OD1' ' A' ' 22' ' ' ASN . 2.1 ttm105 -77.43 -19.26 56.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.715 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.4 tt0 -87.62 -58.59 2.52 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.576 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -60.77 -59.8 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.313 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.704 ' HB ' HG23 ' A' ' 51' ' ' VAL . 0.2 OUTLIER -85.08 -3.08 58.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.42 -178.725 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 60.66 30.81 73.23 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.214 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.488 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 17.1 mm -82.84 147.41 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 117.213 0.507 . . . . 0.0 110.56 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -104.8 -50.67 3.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.99 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -43.36 103.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.548 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 p -68.59 -25.53 64.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.14 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -64.65 -44.86 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.97 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.508 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.8 mp -67.98 -25.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.451 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -69.81 -50.18 45.52 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.877 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.446 ' NE2' HD13 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -59.46 -32.05 69.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.093 -179.966 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -72.74 -38.18 67.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.332 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.783 ' HB2' HD21 ' A' ' 54' ' ' LEU . . . -63.98 -34.7 78.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.746 HD23 ' O ' ' A' ' 40' ' ' LEU . 3.6 tt -65.85 -44.83 84.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.162 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.9 mmtp -59.17 -34.77 72.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.74 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.512 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -86.2 -13.46 46.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.476 ' O ' ' CB ' ' A' ' 44' ' ' ASN . 14.4 m -97.13 -30.34 13.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.315 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.476 ' CB ' ' O ' ' A' ' 43' ' ' SER . 5.7 t30 77.73 24.38 0.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.134 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.12 8.68 47.0 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.438 ' HB3' HD23 ' A' ' 49' ' ' LEU . 94.9 m-20 -97.17 130.95 44.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.576 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -82.54 -63.55 1.35 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.426 -178.151 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.43 ' C ' HD22 ' A' ' 49' ' ' LEU . 2.6 tt0 -45.44 -21.5 0.1 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 49' ' ' LEU . 3.2 mm? -87.97 -45.64 10.05 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.737 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.931 HG13 ' H ' ' A' ' 52' ' ' ALA . 4.2 p -59.87 -61.13 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.931 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -46.55 -42.33 15.7 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.159 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -52.7 -28.83 23.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.81 178.692 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.783 HD21 ' HB2' ' A' ' 39' ' ' ALA . 6.2 mt -83.18 -49.19 9.72 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.48 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.445 ' H ' HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER -82.35 -50.31 9.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.047 0.451 . . . . 0.0 109.889 179.486 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -40.92 157.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.449 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -115.83 -145.03 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.232 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 3.7 t-20 -115.13 -144.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.726 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 70.33 -152.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.561 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.11 173.18 0.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.805 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.535 ' N ' ' CD ' ' A' ' 62' ' ' PRO . 9.0 t -174.71 48.48 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 61' ' ' THR . 38.9 Cg_endo -71.03 -33.18 12.19 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.581 2.188 . . . . 0.0 111.606 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -62.66 -40.57 97.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.269 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.515 ' O ' ' O ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -124.98 95.1 4.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.309 179.721 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.515 ' O ' ' O ' ' A' ' 64' ' ' GLN . 5.5 mt-10 -38.4 165.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.051 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.537 ' O ' ' C ' ' A' ' 67' ' ' THR . 8.4 tp10 -125.56 -20.58 4.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.382 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.537 ' C ' ' O ' ' A' ' 66' ' ' GLU . 33.8 p 28.07 94.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.771 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.585 HG22 ' H ' ' A' ' 69' ' ' TYR . 6.0 m -62.19 -130.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.344 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.585 ' H ' HG22 ' A' ' 68' ' ' THR . 68.6 m-85 53.1 -164.59 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.606 ' O ' ' C ' ' A' ' 71' ' ' GLN . 58.7 t80 66.15 -80.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.606 ' C ' ' O ' ' A' ' 70' ' ' TYR . 6.7 tp-100 -8.81 -91.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.562 0.539 . . . . 0.0 111.244 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.698 HG22 ' N ' ' A' ' 73' ' ' ALA . 52.4 m -61.55 -103.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.195 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.698 ' N ' HG22 ' A' ' 72' ' ' THR . . . 59.71 135.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.4 tp -159.09 98.09 1.64 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.135 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.78 71.22 5.56 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.301 2.001 . . . . 0.0 112.527 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -86.1 161.64 34.64 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.455 ' CG ' ' O ' ' A' ' 77' ' ' ASN . 12.2 p-10 -84.2 90.6 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.771 0.32 . . . . 0.0 110.529 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.61 172.56 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.44 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -96.94 136.5 37.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.661 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -46.24 -46.18 17.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.633 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.12 96.11 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.562 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.7 m -115.82 -10.43 11.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.881 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.18 44.61 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.603 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.437 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . -89.98 -92.37 1.21 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.437 ' CB ' ' O ' ' A' ' 84' ' ' GLY . 3.0 t 75.92 15.15 2.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.792 0.329 . . . . 0.0 110.72 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -105.92 -89.01 0.44 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.615 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.98 134.58 50.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.671 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.568 ' O ' ' O ' ' A' ' 89' ' ' THR . 12.6 m-20 -108.43 94.44 5.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.301 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.568 ' O ' ' O ' ' A' ' 88' ' ' ASP . 2.4 t -23.46 143.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.813 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.533 ' O ' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -157.24 4.37 0.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.75 ' C ' HG22 ' A' ' 92' ' ' ILE . 1.2 m -85.89 156.67 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.886 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.75 HG22 ' C ' ' A' ' 91' ' ' VAL . 1.5 tt 157.28 164.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.851 178.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.642 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 1.6 p30 179.09 105.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.366 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.997 ' H ' HD12 ' A' ' 94' ' ' LEU . 0.6 OUTLIER -86.77 -25.56 24.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.721 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 t -99.17 -16.89 18.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.62 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.522 ' C ' ' OD1' ' A' ' 97' ' ' ASP . . . 51.76 48.38 50.66 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.2 OUTLIER 69.84 125.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 0.0 110.516 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.12 94.11 4.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.443 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -92.13 -45.58 8.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.457 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.22 -33.65 43.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.585 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -72.5 -19.61 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.563 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.592 ' C ' ' N ' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -75.55 -53.41 8.67 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.484 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.429 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -43.91 -19.39 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.755 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.592 ' N ' ' C ' ' A' ' 102' ' ' LEU . 9.6 mtp180 -87.22 -39.21 15.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.391 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -52.88 -57.24 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.506 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -64.83 -55.35 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 CA-C-O 121.602 0.715 . . . . 0.0 110.339 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.01 -46.15 5.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.652 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -59.24 -46.52 88.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.848 180.0 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.519 ' C ' ' N ' ' A' ' 111' ' ' ALA . 6.7 t -68.43 -53.21 25.14 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.616 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 tp -47.48 -17.77 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.99 -56.96 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.576 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -46.32 -24.25 0.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.624 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.649 ' O ' ' N ' ' A' ' 115' ' ' ARG . 58.2 m -90.54 -47.73 7.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.178 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 113' ' ' SER . 16.0 m120 -39.54 -19.14 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.075 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.649 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -112.86 -28.85 7.59 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.547 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -97.59 2.04 49.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.236 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.606 ' N ' ' O ' ' A' ' 113' ' ' SER . 3.5 t80 -91.14 -66.31 0.94 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.239 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.672 ' H ' ' HD2' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -38.0 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.869 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 65.32 66.47 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.567 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.458 ' H ' HG22 ' A' ' 120' ' ' THR . 1.5 t -76.13 80.84 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.458 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -154.55 115.24 0.66 Allowed Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tt -128.46 145.58 35.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.722 0.296 . . . . 0.0 110.389 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.521 ' O ' HG22 ' A' ' 123' ' ' THR . 30.2 m -106.4 -1.81 22.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.866 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.19 -24.16 57.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.624 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.583 ' OE1' ' N ' ' A' ' 126' ' ' GLU . 2.4 tm-20 -58.13 -57.01 14.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.472 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.583 ' N ' ' OE1' ' A' ' 125' ' ' GLU . 20.2 tt0 -48.78 -43.04 37.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.268 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -60.66 -45.93 92.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.255 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.44 -59.39 4.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.377 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.5 mm -42.78 -55.65 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.781 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.05 -52.09 12.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.736 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -46.6 -48.49 19.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.93 -54.66 28.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.786 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -49.7 -44.29 48.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.68 -61.24 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -41.98 -30.13 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 138' ' ' ALA . 1.6 t -71.32 -67.83 0.49 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.492 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.8 pt -65.1 -0.3 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.503 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.423 ' H ' ' C ' ' A' ' 136' ' ' SER . . . -107.47 12.16 28.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.757 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.457 ' CG ' ' H ' ' A' ' 140' ' ' ASN . 0.6 OUTLIER -117.23 -133.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.737 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.457 ' H ' ' CG ' ' A' ' 139' ' ' GLU . 10.8 t-20 -134.63 152.42 51.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.657 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 15.2 mtmm -82.66 -120.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.601 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.605 ' C ' ' SG ' ' A' ' 143' ' ' CYS . . . -90.04 -138.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.728 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.605 ' SG ' ' C ' ' A' ' 142' ' ' ALA . 2.7 m 82.07 52.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.592 ' C ' ' H ' ' A' ' 146' ' ' ARG . 2.8 mt -156.39 -49.8 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.718 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -66.36 16.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.815 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.592 ' H ' ' C ' ' A' ' 144' ' ' LEU . 80.1 mtt-85 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.503 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -157.74 37.32 0.27 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.77 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.432 ' H ' HG23 ' A' ' 3' ' ' VAL . 2.4 t -52.95 96.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.799 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -115.11 140.43 49.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.182 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.665 ' O ' ' ND2' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -154.04 -141.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 0.0 110.978 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.665 ' ND2' ' O ' ' A' ' 5' ' ' GLN . 1.2 p30 160.83 -173.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.323 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 p 178.82 142.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.83 0.348 . . . . 0.0 110.82 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.802 HD23 ' H ' ' A' ' 9' ' ' GLN . 0.4 OUTLIER -168.32 156.93 8.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.644 179.717 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.802 ' H ' HD23 ' A' ' 8' ' ' LEU . 18.7 tt0 -126.31 -143.14 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.088 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.438 ' H ' ' HG2' ' A' ' 9' ' ' GLN . 3.2 mt-30 69.93 131.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.733 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -168.27 1.8 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.563 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.73 -56.44 3.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.641 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.37 -56.44 3.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.705 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -48.37 -22.23 0.66 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.187 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.7 tttt -49.04 -25.62 2.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.116 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -73.51 -59.17 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.512 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.8 OUTLIER -59.57 -29.9 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 179.152 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.595 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 4.7 mt-30 -71.64 -25.22 62.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.316 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -71.08 -51.38 25.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.228 0.537 . . . . 0.0 110.484 -179.527 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.595 ' N ' ' CG2' ' A' ' 19' ' ' THR . 42.6 t80 -60.02 -53.92 52.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.032 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 17' ' ' GLN . 13.3 mt -59.8 -45.75 91.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.148 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.595 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 6.0 t30 -50.05 -49.7 50.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.601 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.3 mm100 -54.9 -56.05 23.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.92 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 ' HB3' ' A' ' 50' ' ' ALA . 1.1 tp -44.92 -28.79 0.71 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.319 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.59 -24.26 24.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.152 0.501 . . . . 0.0 109.939 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' A' ' 23' ' ' GLN . 62.6 tt0 -88.25 -56.67 3.22 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.54 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -52.88 -59.6 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.427 -176.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.622 HG22 HG23 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -87.2 -6.49 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.742 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.421 ' O ' HG21 ' A' ' 61' ' ' THR . . . 70.99 9.9 67.33 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.35 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.527 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 2.0 mm -59.43 153.31 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 117.666 0.733 . . . . 0.0 110.287 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.467 ' N ' HG22 ' A' ' 30' ' ' ILE . 4.4 p30 -113.47 -42.74 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.854 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.1 m-20 -44.89 101.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.557 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.9 m -67.13 -31.51 72.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.191 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.434 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.3 OUTLIER -65.02 -37.03 86.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.857 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.434 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 42.8 mm -67.24 -39.75 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.907 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.564 ' HA ' HD23 ' A' ' 24' ' ' LEU . 7.2 mt -61.19 -60.71 3.34 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.378 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -45.61 -32.87 2.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.041 0.448 . . . . 0.0 110.276 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -81.43 -30.48 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.544 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -74.87 -24.11 58.51 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.0 tm? -77.68 -42.6 34.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.009 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -62.2 -43.22 99.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.532 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 80.4 m-20 -86.19 -22.45 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.707 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -63.93 -30.96 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.629 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.5 m-20 79.88 9.26 1.47 Allowed 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.901 -0.319 . . . . 0.0 110.496 -179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.15 15.45 25.84 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.516 ' CB ' HD22 ' A' ' 49' ' ' LEU . 0.6 OUTLIER -104.85 131.07 52.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.637 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.54 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.96 -61.07 2.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.006 -178.832 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.417 ' C ' HG12 ' A' ' 51' ' ' VAL . 5.2 mt-10 -54.01 -25.84 23.25 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 1.179 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -88.53 -25.98 22.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.115 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 1.179 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -79.85 -54.21 6.04 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 55' ' ' THR . 11.6 p -44.11 -40.18 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.683 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -64.9 -33.64 76.5 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.425 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.634 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.7 OUTLIER -54.35 -33.1 58.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.523 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.75 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -87.59 -52.48 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.836 -179.082 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 51' ' ' VAL . 2.8 p -70.12 -43.19 71.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.313 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . -22.45 -39.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.734 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.695 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -101.92 -69.98 0.76 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.609 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.613 ' O ' ' HB2' ' A' ' 59' ' ' ALA . 0.9 OUTLIER -148.81 -177.59 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.504 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.613 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 167.67 139.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.813 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.591 ' O ' ' OG1' ' A' ' 61' ' ' THR . 16.0 tttt -150.9 136.15 17.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.591 ' OG1' ' O ' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -176.55 78.12 0.26 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.452 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -83.04 -18.82 6.06 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.035 2.49 . . . . 0.0 112.275 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -55.6 -32.75 63.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.751 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.48 67.94 4.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.641 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -117.9 64.12 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.603 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.588 ' O ' ' OG1' ' A' ' 67' ' ' THR . 9.5 mp0 -106.2 104.56 14.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.698 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 66' ' ' GLU . 2.5 m -174.06 -3.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.225 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 69' ' ' TYR . 6.5 t -62.52 -41.1 98.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.588 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 70' ' ' TYR . 66.9 t80 61.73 112.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.498 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.6 ' O ' ' CD2' ' A' ' 69' ' ' TYR . 1.4 p90 -54.56 179.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.668 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.518 ' O ' ' O ' ' A' ' 72' ' ' THR . 0.0 OUTLIER -117.29 44.41 2.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.51 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.518 ' O ' ' O ' ' A' ' 71' ' ' GLN . 68.0 p 37.36 97.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.503 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.64 -100.4 0.3 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.727 HD23 ' H ' ' A' ' 76' ' ' GLY . 4.0 tt -132.55 95.8 19.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.404 ' C ' ' H ' ' A' ' 77' ' ' ASN . 62.3 Cg_exo -46.53 -29.06 6.92 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.524 2.149 . . . . 0.0 112.166 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.727 ' H ' HD23 ' A' ' 74' ' ' LEU . . . 66.47 -2.18 4.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.653 ' OD1' ' N ' ' A' ' 78' ' ' ASP . 51.0 t-20 37.84 -138.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.515 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.653 ' N ' ' OD1' ' A' ' 77' ' ' ASN . 3.8 p30 -148.29 108.73 4.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.668 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.43 ' O ' ' C ' ' A' ' 80' ' ' TYR . 11.3 mmm180 -83.37 -27.52 29.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.615 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.43 ' C ' ' O ' ' A' ' 79' ' ' ARG . 7.6 m-85 -36.44 -46.64 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.963 -179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.02 90.6 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.06 -153.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.124 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.0 m -84.89 172.96 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.39 79.21 0.02 OUTLIER Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.2 p -116.87 -64.1 1.36 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.446 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -130.22 -137.68 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.466 ' C ' ' H ' ' A' ' 89' ' ' THR . . . -168.21 116.16 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.706 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.427 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 2.1 m-20 -74.49 34.74 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . 0.466 ' H ' ' C ' ' A' ' 87' ' ' ALA . 0.1 OUTLIER -111.01 153.2 25.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.613 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 89' ' ' THR . 0.6 OUTLIER -179.7 35.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.196 0.522 . . . . 0.0 109.601 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.16 175.7 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.251 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.633 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 2.4 tt 177.6 164.23 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.975 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.633 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 76.9 m-20 51.74 175.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.382 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -129.25 -27.87 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.592 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 97' ' ' ASP . 1.9 t -91.19 -35.55 14.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.82 -17.21 20.49 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.642 ' H ' HG23 ' A' ' 95' ' ' THR . 0.1 OUTLIER 58.28 30.53 19.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 110.45 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -84.46 86.86 7.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.671 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HG3' ' H ' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -69.82 -12.53 61.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.598 179.94 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -15.81 61.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.502 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -32.38 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.851 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.603 ' C ' HD12 ' A' ' 102' ' ' LEU . 1.1 pp -65.54 -33.2 75.36 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.653 ' HA ' HD11 ' A' ' 106' ' ' ILE . 1.1 tm0? -57.69 -19.32 26.23 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -87.11 -29.22 22.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.166 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.96 -57.8 10.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.239 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.844 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -71.79 -35.31 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.712 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.844 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -57.38 -52.54 64.94 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.2 -38.87 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.557 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.473 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -70.33 -42.89 71.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.232 179.463 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.4 mp -48.55 -19.14 0.3 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.473 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.1 2.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.406 179.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -47.43 -20.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.942 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.6 OUTLIER -88.51 -51.75 5.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.007 179.634 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 114' ' ' ASN . 62.1 t-20 -45.99 -12.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.584 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -101.56 -37.72 8.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.602 179.346 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.509 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -92.9 15.17 15.44 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.058 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.52 ' CE2' ' O ' ' A' ' 118' ' ' ARG . 3.3 p90 -58.38 164.52 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.692 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.52 ' O ' ' CE2' ' A' ' 117' ' ' PHE . 28.5 mtm180 -54.92 94.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.459 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.481 ' CA ' ' OE1' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -83.73 36.98 0.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.958 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.56 ' OG1' ' N ' ' A' ' 121' ' ' GLY . 0.0 OUTLIER -77.05 -103.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.44 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLY . . . . . 0.56 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 69.7 61.7 4.25 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.685 ' O ' ' N ' ' A' ' 124' ' ' ASP . 1.2 tt -163.84 145.42 2.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.716 0.293 . . . . 0.0 110.535 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.543 ' C ' ' O ' ' A' ' 122' ' ' ILE . 43.7 m -28.29 84.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.529 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.685 ' N ' ' O ' ' A' ' 122' ' ' ILE . 0.2 OUTLIER -63.62 171.22 2.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.539 -179.783 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -68.81 -55.99 9.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.34 -40.6 65.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.392 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -25.9 65.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -75.72 -57.48 3.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.702 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.2 mt -53.8 -45.56 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.677 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 131' ' ' ARG . 1.4 t -60.54 -64.97 0.77 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.671 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 130' ' ' SER . 5.7 mtp85 -38.54 -49.95 1.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 128' ' ' ALA . 46.6 t -58.75 -51.32 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.721 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.4 ' O ' ' OG ' ' A' ' 136' ' ' SER . 5.0 mt -43.46 -57.46 3.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.758 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.434 ' C ' ' OE1' ' A' ' 134' ' ' GLU . 11.8 tm-20 -53.11 -57.33 10.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.586 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -50.91 -26.18 5.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 132' ' ' VAL . 0.2 OUTLIER -74.76 -62.69 1.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.54 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 1.9 pt -66.96 -6.67 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.748 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.56 61.52 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.666 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.574 ' O ' ' O ' ' A' ' 140' ' ' ASN . 1.3 tp10 -94.59 -75.33 0.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.6 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.574 ' O ' ' O ' ' A' ' 139' ' ' GLU . 0.3 OUTLIER 43.15 105.74 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.638 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.502 ' O ' ' C ' ' A' ' 142' ' ' ALA . 31.7 mttm -77.19 46.82 0.52 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.574 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . -32.11 97.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.653 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.443 ' N ' ' O ' ' A' ' 141' ' ' LYS . 4.0 m -156.45 152.84 27.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.57 ' O ' ' O ' ' A' ' 145' ' ' LYS . 4.0 mm? -72.54 171.54 12.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.711 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LYS . . . . . 0.57 ' O ' ' O ' ' A' ' 144' ' ' LEU . 10.7 ttmm 25.81 99.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.867 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.401 ' HG2' ' H ' ' A' ' 146' ' ' ARG . 13.1 ptt-85 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.51 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.0 mtt . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.516 ' O ' ' C ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -94.95 78.53 3.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.398 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.718 ' O ' HG13 ' A' ' 3' ' ' VAL . 10.3 p -28.32 100.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.619 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.18 22.95 7.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.638 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.89 -107.9 0.22 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.388 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.78 88.83 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.814 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -131.15 -22.02 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.363 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.774 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -57.07 -52.91 63.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.62 -31.02 72.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -63.52 -179.52 0.36 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.3 t -130.8 -64.71 0.82 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.608 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.439 ' O ' ' N ' ' A' ' 14' ' ' GLN . . . -72.71 -49.7 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.688 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -45.01 -20.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.632 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 12' ' ' ALA . 14.0 tm0? -50.18 -18.55 0.6 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.353 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 pttm -52.14 -19.15 1.79 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.713 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -75.24 -24.45 57.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.402 HE21 HD11 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -46.93 -31.41 3.13 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.396 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -46.59 -41.88 15.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.364 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.425 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -68.04 -40.18 82.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.533 0.682 . . . . 0.0 109.651 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.599 ' CE1' HD22 ' A' ' 47' ' ' LEU . 10.0 t80 -57.82 -56.25 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.934 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.1 mt -64.22 -45.76 86.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.974 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.512 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 14.0 t-20 -46.45 -38.72 9.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -42.99 84.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.741 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.825 ' O ' HG22 ' A' ' 28' ' ' THR . 20.3 mt -54.45 -58.66 6.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -59.03 -18.09 31.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.278 0.561 . . . . 0.0 109.702 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -76.94 -44.73 30.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.288 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.645 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -91.38 -41.31 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.423 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.825 HG22 ' O ' ' A' ' 24' ' ' LEU . 3.8 t -95.18 -4.73 45.44 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.941 -177.283 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.52 31.52 66.99 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.41 -0.424 . . . . 0.0 112.449 178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.71 ' HB ' HD21 ' A' ' 36' ' ' LEU . 47.1 mm -90.07 112.39 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.586 -0.445 . . . . 0.0 110.056 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.494 ' O ' ' N ' ' A' ' 33' ' ' THR . 6.0 p-10 -76.66 -41.7 44.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.421 ' OD1' ' ND2' ' A' ' 31' ' ' ASN . 0.9 OUTLIER -50.16 90.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.411 -179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.552 ' HA ' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -58.03 -37.09 73.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.772 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.37 -44.12 84.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.031 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.3 mm -67.88 -28.85 42.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.253 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.728 HD22 ' HB3' ' A' ' 24' ' ' LEU . 96.3 mt -69.33 -51.78 33.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.166 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -53.22 -27.29 21.16 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.47 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.39 -25.18 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.326 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.98 -40.01 32.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.246 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.069 HD22 ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.77 -29.7 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.019 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.859 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -69.7 -43.92 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.766 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.47 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.7 m-20 -74.55 -19.31 60.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.776 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.739 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -82.97 -30.79 27.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.928 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.739 ' ND2' ' O ' ' A' ' 43' ' ' SER . 0.0 OUTLIER 80.66 23.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.095 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.52 8.63 42.98 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.548 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.1 m120 -96.58 130.75 43.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.688 ' O ' HG12 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -83.46 -63.05 1.43 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.447 ' C ' HD22 ' A' ' 49' ' ' LEU . 21.2 tt0 -45.56 -21.82 0.12 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.698 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.8 mm? -85.87 -42.89 13.72 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.31 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.667 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -61.11 -56.74 17.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 52' ' ' ALA . 1.1 p -50.16 -65.17 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.991 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.83 -42.26 12.14 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.037 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -54.78 -31.11 58.41 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.62 ' CD1' HD22 ' A' ' 24' ' ' LEU . 3.3 mt -87.15 -50.23 6.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.293 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -67.26 -50.55 60.08 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -47.74 -60.3 2.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.503 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.7 tptt 63.67 113.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.388 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 15.5 m120 -137.46 44.66 2.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.712 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 69.3 127.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.892 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.631 ' O ' ' CB ' ' A' ' 61' ' ' THR . 23.4 tptt -128.69 -81.5 0.58 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.646 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.631 ' CB ' ' O ' ' A' ' 60' ' ' LYS . 1.3 m 92.04 63.71 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.13 0.491 . . . . 0.0 110.573 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.55 ' HD3' ' H ' ' A' ' 61' ' ' THR . 84.9 Cg_endo -86.05 -4.48 8.77 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 123.38 2.72 . . . . 0.0 111.843 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -40.03 -79.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.698 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -126.07 69.95 1.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.644 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -126.9 57.11 1.47 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.451 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -155.52 128.57 8.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.562 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.9 t -173.15 -13.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.235 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' N ' ' A' ' 69' ' ' TYR . 11.9 t -158.99 -152.17 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.229 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.525 ' CD2' ' O ' ' A' ' 69' ' ' TYR . 22.2 p90 -153.89 110.84 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.699 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.559 ' O ' ' O ' ' A' ' 71' ' ' GLN . 0.3 OUTLIER -128.52 -60.19 1.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.544 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.559 ' O ' ' O ' ' A' ' 70' ' ' TYR . 0.9 OUTLIER -38.29 167.77 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.783 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.405 ' C ' ' O ' ' A' ' 71' ' ' GLN . 73.7 p 38.99 68.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.329 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.71 2.34 41.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.76 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.06 122.36 74.69 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.139 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.74 47.97 0.76 Allowed 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.11 1.873 . . . . 0.0 112.205 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 80.16 -167.8 51.32 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -97.87 -124.23 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.93 0.395 . . . . 0.0 110.712 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -170.78 149.74 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.515 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.499 ' O ' ' C ' ' A' ' 80' ' ' TYR . 12.2 mtt180 -72.23 72.13 0.9 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.567 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.499 ' C ' ' O ' ' A' ' 79' ' ' ARG . 0.2 OUTLIER -32.81 -59.04 0.35 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.337 179.879 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 134.89 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.31 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.486 ' O ' ' C ' ' A' ' 83' ' ' VAL . 1.4 p -173.54 -48.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.618 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' VAL . . . . . 0.486 ' C ' ' O ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -32.3 115.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.691 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.4 -68.07 1.08 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.661 ' O ' ' CB ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER 168.53 -84.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.545 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 85' ' ' SER . 5.3 tp-100 139.43 -70.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.987 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.521 ' O ' ' C ' ' A' ' 88' ' ' ASP . . . 55.09 -127.81 2.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.521 ' C ' ' O ' ' A' ' 87' ' ' ALA . 46.1 t0 30.59 67.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.561 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.8 m -159.42 121.18 3.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.724 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -171.45 7.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.268 0.556 . . . . 0.0 109.584 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.587 HG23 ' H ' ' A' ' 92' ' ' ILE . 0.3 OUTLIER -58.99 -91.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.308 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.818 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.4 OUTLIER 33.12 -162.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.521 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.818 ' N ' HG23 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -141.15 147.06 37.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.663 -179.859 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.7 -28.8 6.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -108.22 -38.11 5.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.875 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 51.37 54.68 22.87 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -166.31 155.5 11.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 0.0 110.656 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.725 ' O ' HD23 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -59.1 157.56 10.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.544 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.4 mtmm -95.82 -19.09 19.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.596 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -86.99 -47.43 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.791 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.426 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER -51.19 -33.97 29.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.964 0.412 . . . . 0.0 110.281 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 98' ' ' ASP . 4.2 mm? -55.38 -33.77 63.73 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 120.417 -0.513 . . . . 0.0 109.658 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.684 ' HA ' HD11 ' A' ' 106' ' ' ILE . 21.3 tp60 -55.18 -19.74 8.67 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.426 ' CB ' ' O ' ' A' ' 101' ' ' ASP . 23.7 ttt180 -85.92 -32.57 21.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.354 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.68 -57.8 11.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.547 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.684 HD11 ' HA ' ' A' ' 103' ' ' GLN . 0.7 OUTLIER -74.24 -31.86 30.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 CA-C-O 121.087 0.47 . . . . 0.0 111.188 -179.118 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.15 -52.18 64.86 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.25 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.3 mp -57.83 -38.7 76.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.987 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.503 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -72.36 -54.66 8.8 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.191 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.404 ' HA ' HD22 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -47.49 -17.93 0.11 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.537 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -85.88 -47.72 9.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.301 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 116' ' ' ALA . 4.8 mm-40 -45.05 -22.53 0.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.643 ' O ' ' N ' ' A' ' 115' ' ' ARG . 62.0 m -92.55 -54.63 3.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.86 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -41.3 -13.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.138 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.643 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -121.33 -32.91 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.17 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.426 ' CB ' ' O ' ' A' ' 112' ' ' GLU . . . -80.48 -7.63 59.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.483 ' N ' ' O ' ' A' ' 113' ' ' SER . 55.7 t80 -58.19 -110.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.444 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.451 ' N ' ' CG ' ' A' ' 117' ' ' PHE . 18.3 mtm180 -133.12 42.18 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.564 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.68 33.5 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.555 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 30.4 p -67.01 178.85 1.27 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.558 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 65.22 112.12 0.01 OUTLIER Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.606 ' C ' ' H ' ' A' ' 124' ' ' ASP . 2.5 tp -91.72 25.36 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.821 0.343 . . . . 0.0 110.514 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 124' ' ' ASP . 5.9 p 59.53 -6.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.611 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.653 ' N ' ' OD1' ' A' ' 124' ' ' ASP . 0.2 OUTLIER 37.36 83.45 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.539 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.541 ' H ' ' CD ' ' A' ' 125' ' ' GLU . 1.1 pm0 -70.83 -53.95 13.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.522 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -54.89 -44.77 74.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.516 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 124' ' ' ASP . 14.4 mm100 -65.02 -31.11 72.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.546 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -59.4 -75.67 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.397 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 130' ' ' SER . 18.9 tt -44.58 -45.67 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.319 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.579 ' N ' HG23 ' A' ' 129' ' ' ILE . 4.0 p -57.55 -40.95 79.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.28 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -47.54 63.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.195 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.555 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 21.8 t -56.16 -43.51 76.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.123 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.39 -56.52 16.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.209 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.47 -37.34 56.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.315 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -24.1 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.466 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.747 ' O ' ' HB3' ' A' ' 138' ' ' ALA . 49.7 mm -85.14 -28.14 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.511 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.747 ' HB3' ' O ' ' A' ' 137' ' ' ILE . . . 90.35 58.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -50.93 -2.23 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.229 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ASN . . . . . 0.611 ' H ' ' C ' ' A' ' 138' ' ' ALA . 17.4 t30 -83.08 73.59 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.641 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.451 ' HD2' ' H ' ' A' ' 141' ' ' LYS . 1.1 mptm? -36.94 146.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.575 ' O ' ' O ' ' A' ' 143' ' ' CYS . . . -80.94 107.33 13.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' CYS . . . . . 0.575 ' O ' ' O ' ' A' ' 142' ' ' ALA . 0.1 OUTLIER 46.46 110.29 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 144' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 144' ' ' LEU . 0.1 OUTLIER -42.72 -58.95 2.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.315 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -176.2 77.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.526 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.482 HH11 ' HD3' ' A' ' 146' ' ' ARG . 7.0 mtp180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.561 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.538 ' NE2' ' N ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 CA-C-O 121.024 0.44 . . . . 0.0 109.856 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -60.43 -54.19 48.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.539 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.623 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -62.73 -51.5 66.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.725 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.623 ' N ' ' CG2' ' A' ' 19' ' ' THR . 55.9 t80 -55.75 -53.02 61.72 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.143 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' A' ' 37' ' ' GLN . 27.9 mt -62.56 -48.45 79.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.287 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -50.22 -43.55 52.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.246 178.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.4 mt-30 -56.73 -53.54 56.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.087 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 54' ' ' LEU . 11.7 mt -43.29 -35.39 1.47 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 123.336 0.397 . . . . 0.0 110.779 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -76.42 -21.41 56.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.174 0.511 . . . . 0.0 109.79 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.664 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.8 tt0 -87.36 -58.49 2.56 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.537 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -59.18 -59.6 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.431 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.6 OUTLIER -82.65 -2.84 55.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 -178.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.42 25.02 59.99 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.768 HG22 ' H ' ' A' ' 32' ' ' ASP . 3.3 mm -69.28 159.78 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.131 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.474 ' N ' HG22 ' A' ' 30' ' ' ILE . 17.2 m-20 -132.36 22.25 4.39 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.283 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.768 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -103.85 121.19 42.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.461 ' O ' ' OE1' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -82.07 -26.48 33.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.249 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.407 ' HA ' HE21 ' A' ' 34' ' ' GLN . 2.1 mm-40 -83.96 -46.75 11.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 0.0 111.151 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 35' ' ' ILE . 6.3 mm -66.8 -20.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.081 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -74.12 -63.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.064 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.61 ' HA ' HD21 ' A' ' 21' ' ' LEU . 7.1 pt20 -50.86 -25.0 3.98 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -75.47 -38.99 59.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.388 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.408 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -65.34 -19.15 65.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.895 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.485 HD13 ' CE2' ' A' ' 20' ' ' PHE . 12.2 tp -79.14 -52.99 7.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.603 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -51.81 -33.77 37.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -27.77 27.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.59 ' OG ' ' N ' ' A' ' 50' ' ' ALA . 3.6 m -80.51 -30.65 37.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.815 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 61.92 35.05 16.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.289 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.33 4.63 50.04 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.681 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.425 ' ND2' ' O ' ' A' ' 43' ' ' SER . 6.6 m-80 -93.8 130.96 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -84.76 -62.62 1.5 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.71 -178.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -52.75 -21.87 4.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.025 0.441 . . . . 0.0 110.289 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -81.49 -54.85 5.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.199 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.59 ' N ' ' OG ' ' A' ' 43' ' ' SER . . . -52.44 -36.75 55.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.479 ' O ' HG22 ' A' ' 55' ' ' THR . 1.0 OUTLIER -63.26 -49.53 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.34 177.697 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.446 ' N ' HG12 ' A' ' 51' ' ' VAL . . . -57.0 -44.13 82.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.785 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -60.55 -24.56 65.48 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.863 -0.735 . . . . 0.0 110.816 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.575 ' CD1' HD22 ' A' ' 24' ' ' LEU . 68.6 mt -87.37 -53.57 4.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.744 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.479 HG22 ' O ' ' A' ' 51' ' ' VAL . 12.9 t . . . . . 0 C--N 1.329 -0.32 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.448 ' N ' ' OD1' ' A' ' 101' ' ' ASP . 1.0 OUTLIER . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.075 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.831 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -56.12 -35.65 67.32 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.581 -179.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.455 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 2.1 tt0 -53.91 -19.51 4.66 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.441 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.1 ttt180 -86.54 -33.05 20.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.857 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.55 -53.97 49.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.159 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.476 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.68 -47.33 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.352 0.596 . . . . 0.0 110.573 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.82 -57.34 7.56 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.158 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -46.59 -44.75 18.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.102 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.467 ' C ' ' N ' ' A' ' 111' ' ' ALA . 8.7 t -63.87 -44.43 93.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.218 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -48.61 -19.02 0.3 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.45 -57.99 2.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.65 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -47.77 -18.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.307 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.435 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.627 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.414 ' CD ' ' N ' ' A' ' 126' ' ' GLU . 1.9 pp20? . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.782 0.325 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' A' ' 125' ' ' GLU . 1.8 tt0 -55.42 -53.26 58.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.862 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.51 -27.67 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.632 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 130' ' ' SER . . . -72.91 -84.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.619 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.544 ' C ' ' O ' ' A' ' 128' ' ' ALA . 2.6 mt -26.9 -39.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.77 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.59 ' N ' ' O ' ' A' ' 128' ' ' ALA . 9.1 m -62.43 -68.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.645 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -43.49 -25.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.677 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 41.7 t -75.42 -62.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.447 ' C ' ' O ' ' A' ' 132' ' ' VAL . 14.5 mt -37.55 -56.18 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 135' ' ' ALA . 39.9 tt0 -56.09 -41.21 74.83 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.875 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -36.4 -61.0 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -60.21 -43.34 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.12 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.462 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -81.03 -42.06 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.215 0.531 . . . . 0.0 110.853 -179.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.462 ' N ' ' CG2' ' A' ' 19' ' ' THR . 29.4 t80 -56.84 -56.86 16.17 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.564 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.0 mt -64.46 -39.91 94.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.105 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.62 -40.73 75.87 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.07 -47.5 80.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.056 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.541 HD11 ' HB1' ' A' ' 50' ' ' ALA . 14.7 mt -51.16 -53.57 33.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.179 0.514 . . . . 0.0 110.644 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.668 ' C ' ' HE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -60.07 -16.57 32.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.26 0.553 . . . . 0.0 109.593 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -82.08 -57.47 3.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.542 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -78.27 -46.81 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.365 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.542 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.0 t -92.35 -3.17 55.75 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.665 -177.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.57 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . 62.72 -7.6 0.25 Allowed Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.708 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.537 HG13 HD23 ' A' ' 54' ' ' LEU . 41.1 mm -59.17 97.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 117.911 0.856 . . . . 0.0 110.301 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 29' ' ' GLY . 3.8 m-20 -83.06 36.56 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.134 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -106.91 85.56 2.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.9 0.381 . . . . 0.0 110.114 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -43.7 -37.05 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.019 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -47.22 83.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.656 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.7 mp -75.62 -33.08 25.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.657 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.548 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.8 mt -65.35 -63.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -51.3 -28.13 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.097 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -78.21 -39.43 40.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.84 82.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.048 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.2 tm? -67.93 -43.05 80.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.79 -40.26 20.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.577 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.5 t0 -87.3 -40.19 14.7 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.602 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -63.87 -24.29 67.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.682 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 1.4 p-10 50.35 42.15 25.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.558 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.409 ' C ' HD22 ' A' ' 46' ' ' ASN . . . 102.64 -1.39 49.13 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.063 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.61 HD22 ' N ' ' A' ' 46' ' ' ASN . 0.8 OUTLIER -96.85 122.8 40.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 50' ' ' ALA . 21.6 tp -84.99 -61.79 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.248 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.539 ' C ' HD22 ' A' ' 49' ' ' LEU . 5.3 mt-10 -42.73 -21.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.774 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -89.61 -39.3 13.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.618 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -67.38 -54.83 17.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.755 HG13 ' N ' ' A' ' 52' ' ' ALA . 10.1 p -53.46 -53.16 26.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.755 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.54 -45.02 66.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.455 -1.248 . . . . 0.0 109.586 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -49.18 -27.81 3.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.636 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.2 mp -85.86 -52.42 5.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.737 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.409 HG22 ' H ' ' A' ' 55' ' ' THR . 2.6 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.479 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.714 0.292 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.668 HD22 ' H ' ' A' ' 102' ' ' LEU . 2.4 mm? -73.02 -46.43 52.1 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.118 0.485 . . . . 0.0 109.84 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -44.99 -20.11 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.538 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.2 ttt-85 -85.69 -45.79 11.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.116 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -53.97 -47.42 71.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.87 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.2 mm -62.28 -57.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 121.668 0.747 . . . . 0.0 109.924 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -45.31 -44.02 11.2 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.055 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.31 -39.23 66.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.148 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.464 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.7 OUTLIER -73.49 -46.73 46.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.238 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 110' ' ' LEU . 1.6 mm? -48.39 -17.89 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.464 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -87.99 -58.41 2.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.572 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -47.58 -24.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.929 179.364 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.857 0.361 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.4 -49.65 76.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.631 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.42 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.1 OUTLIER -67.78 -30.33 69.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.521 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.48 73.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.541 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.8 mt -59.76 -58.21 8.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.587 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.91 -37.94 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.497 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.66 -56.65 18.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.533 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 132' ' ' VAL . 4.1 t -44.38 -36.01 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.52 ' O ' ' C ' ' A' ' 134' ' ' GLU . 2.4 mp -67.69 -89.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.966 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.52 ' C ' ' O ' ' A' ' 133' ' ' LEU . 31.4 mt-10 -33.58 -49.72 0.31 Allowed 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.449 ' C ' ' O ' ' A' ' 134' ' ' GLU . . . -37.44 -69.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.479 ' O ' ' OG ' ' A' ' 136' ' ' SER . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.261 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.873 0.368 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -59.89 -55.09 38.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.622 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.601 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -68.51 -48.36 64.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.297 0.57 . . . . 0.0 110.313 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.601 ' N ' ' CG2' ' A' ' 19' ' ' THR . 40.0 t80 -47.35 -60.28 2.61 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.972 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.86 -52.07 65.64 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.956 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -45.14 -32.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.692 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -71.87 -48.8 43.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.882 179.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 1.057 HD21 ' HB1' ' A' ' 50' ' ' ALA . 1.9 mp -45.24 -25.67 0.4 Allowed 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.426 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -88.38 -24.39 23.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.766 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.692 ' N ' ' O ' ' A' ' 23' ' ' GLN . 5.6 tm-20 -86.84 -57.77 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.35 -59.68 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.113 -177.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.5 -5.14 58.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.787 -179.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.35 32.65 76.01 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.209 -0.519 . . . . 0.0 111.893 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.407 HG22 ' N ' ' A' ' 31' ' ' ASN . 3.1 mm -88.25 153.58 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.66 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.589 ' N ' ' OD1' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -108.08 -54.57 2.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.907 -179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.618 ' HB2' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -41.24 101.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.353 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.3 m -66.7 -24.81 66.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.164 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -69.04 -51.71 36.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.756 0.312 . . . . 0.0 110.857 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.618 HD12 ' HB2' ' A' ' 32' ' ' ASP . 69.8 mt -53.21 -20.59 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.603 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -80.18 -60.66 2.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.725 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -43.38 -25.2 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.574 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.22 -39.87 32.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.004 179.349 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -63.18 -36.4 83.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.817 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.79 HD23 ' O ' ' A' ' 40' ' ' LEU . 7.0 tt -66.57 -40.45 88.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.005 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -52.83 -39.19 62.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.024 0.44 . . . . 0.0 109.891 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.4 m-20 -86.76 -30.0 21.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.502 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 0.1 OUTLIER -79.38 -21.47 45.68 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.083 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 40' ' ' LEU . 36.3 m120 62.21 29.85 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.939 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.45 1.42 53.53 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.502 ' N ' ' OG ' ' A' ' 43' ' ' SER . 5.2 m-20 -88.07 130.65 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.257 . . . . 0.0 110.378 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.478 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -83.98 -63.39 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.242 -178.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.562 ' C ' HD22 ' A' ' 49' ' ' LEU . 11.9 mt-10 -45.66 -22.4 0.17 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.42 0.629 . . . . 0.0 109.533 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.799 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -89.71 -41.17 12.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.316 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 1.057 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -63.23 -46.89 84.8 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.803 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.9 p -58.75 -59.12 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.803 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -50.07 -40.19 44.63 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.458 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -53.93 -32.84 54.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.161 179.096 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.568 HD12 ' O ' ' A' ' 50' ' ' ALA . 5.4 mp -85.76 -51.95 6.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.354 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 51' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.112 179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.9 t0 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.782 0.325 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.4 tt -71.86 -54.46 10.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.209 0.528 . . . . 0.0 110.292 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.411 ' N ' HD23 ' A' ' 102' ' ' LEU . 26.4 tp60 -43.96 -17.96 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 178.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.599 ' N ' ' C ' ' A' ' 102' ' ' LEU . 3.6 tpt180 -86.69 -37.72 17.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.372 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -59.93 -38.75 83.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.206 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.483 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -75.06 -37.25 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.555 0.693 . . . . 0.0 110.023 179.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -56.87 14.09 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.123 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 12.2 tp -48.48 -53.94 16.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.116 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 105' ' ' ALA . 0.7 OUTLIER -57.69 -49.28 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.833 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.7 mt -48.32 -17.93 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.33 -54.55 5.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.612 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.481 ' CD ' ' N ' ' A' ' 112' ' ' GLU . 0.3 OUTLIER -46.6 -23.13 0.35 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.415 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.903 179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.742 0.306 . . . . 0.0 110.681 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -58.31 -36.58 73.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.787 ' H ' HE21 ' A' ' 127' ' ' GLN . 0.0 OUTLIER -77.55 -51.02 11.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.748 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.83 -44.36 39.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.553 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.41 -62.1 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.508 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.27 -16.84 9.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.813 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.1 ttt-85 -76.03 -52.15 10.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.615 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 48.3 t -64.55 -52.93 48.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.406 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 133' ' ' LEU . 0.9 OUTLIER -47.69 -52.88 16.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.572 179.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -51.64 -52.1 50.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.402 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.37 -13.07 2.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.415 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.462 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.762 0.315 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -55.36 -44.98 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.53 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.676 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -69.25 -43.5 73.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.644 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 40' ' ' LEU . 38.3 t80 -50.96 -58.15 6.76 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.431 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.47 -42.27 96.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.004 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.59 -41.29 41.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.702 ' N ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -60.31 -46.54 89.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.095 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 28' ' ' THR . 40.9 mt -50.35 -57.95 6.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 109.927 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.429 ' CG ' ' O ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.07 -17.31 38.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.209 0.528 . . . . 0.0 109.752 179.333 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -78.86 -48.77 14.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.714 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.57 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -89.86 -46.92 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.162 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 24' ' ' LEU . 2.8 t -87.39 -2.84 58.9 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.373 -177.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.06 32.44 71.07 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.698 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.598 ' HB ' HD21 ' A' ' 36' ' ' LEU . 40.3 mm -89.77 128.65 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.281 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -94.03 -47.94 6.46 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.304 -179.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -41.07 98.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.576 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -77.11 -39.95 47.63 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.732 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.47 HG22 ' CD2' ' A' ' 54' ' ' LEU . 34.2 mm -72.46 -21.26 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 24' ' ' LEU . 87.8 mt -76.0 -63.51 1.3 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.271 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.04 -26.0 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -73.53 -37.45 65.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.632 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.585 ' O ' ' OD1' ' A' ' 42' ' ' ASP . . . -60.37 -42.6 96.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.732 179.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.053 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.68 -36.06 79.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.379 179.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -53.44 -41.15 65.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.025 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.7 ' OD1' ' CD2' ' A' ' 53' ' ' PHE . 7.1 p30 -87.25 -23.96 24.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.478 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.583 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.4 OUTLIER -77.52 -7.52 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.686 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.692 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 56.77 25.22 9.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.214 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.43 ' HA2' HD13 ' A' ' 40' ' ' LEU . . . 102.45 -5.87 52.3 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.58 ' O ' ' OG ' ' A' ' 43' ' ' SER . 5.8 m120 -84.39 131.6 34.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 49' ' ' LEU . 13.2 tp -83.25 -64.11 1.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.52 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.458 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.1 tt0 -42.34 -21.02 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.691 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -88.0 -45.84 9.86 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.844 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.626 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -55.2 -53.06 60.83 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.928 HG13 ' H ' ' A' ' 52' ' ' ALA . 3.9 p -57.19 -62.86 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.558 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.928 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.24 -35.22 3.22 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.242 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.7 ' CD2' ' OD1' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -64.35 -30.37 71.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.141 179.027 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 24' ' ' LEU . 9.3 mt -87.87 -43.83 11.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.387 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.2 t . . . . . 0 C--N 1.33 -0.248 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.004 -179.626 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.6 t70 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.705 0.288 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 104' ' ' ARG . 1.2 tp -71.37 -53.67 13.35 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.15 0.5 . . . . 0.0 110.696 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.421 ' C ' ' O ' ' A' ' 102' ' ' LEU . 26.1 tp60 -43.83 -18.6 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.588 ' N ' ' O ' ' A' ' 102' ' ' LEU . 1.4 mtp180 -86.64 -38.96 16.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.609 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -54.28 -57.78 9.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.398 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.517 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.64 -57.22 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.756 0.788 . . . . 0.0 109.868 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -44.09 -39.61 4.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.343 -1.299 . . . . 0.0 110.128 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.65 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.3 OUTLIER -59.15 -44.23 92.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.923 179.482 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.45 ' C ' ' N ' ' A' ' 111' ' ' ALA . 2.7 t -68.4 -48.34 64.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.51 -17.25 0.76 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.65 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -80.19 -58.85 2.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.039 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -46.82 -25.81 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.864 179.186 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.797 0.332 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -39.54 74.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.221 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.513 ' C ' ' CD ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -71.18 -35.71 71.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.907 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.4 -70.98 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.364 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.4 mt -44.68 -39.14 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.4 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 t -55.69 -56.69 17.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.412 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 27.7 ttt-85 -52.3 -51.69 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.05 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.592 ' O ' ' OG ' ' A' ' 136' ' ' SER . 33.2 t -47.46 -71.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.162 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.513 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.1 OUTLIER -30.03 -68.78 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.317 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.619 ' C ' ' H ' ' A' ' 136' ' ' SER . 29.2 tt0 -48.29 -59.85 3.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.717 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.18 4.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.694 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.619 ' H ' ' C ' ' A' ' 134' ' ' GLU . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.658 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.653 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 8.6 mp0 . . . . . 0 N--CA 1.457 -0.109 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 4.4 mm100 -64.19 -56.52 14.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.191 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.606 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -75.53 -47.99 24.46 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.331 0.586 . . . . 0.0 110.533 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.606 ' N ' ' CG2' ' A' ' 19' ' ' THR . 61.4 t80 -46.79 -50.56 18.09 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.204 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.583 HD21 ' HA ' ' A' ' 37' ' ' GLN . 54.0 mt -69.33 -52.02 31.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.157 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 9.5 t30 -45.17 -37.9 4.85 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.635 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.3 mp0 -61.63 -55.72 27.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.881 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 36' ' ' LEU . 9.0 mt -45.82 -21.87 0.15 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.256 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -87.9 -23.4 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.137 179.275 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.635 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.6 tt0 -87.53 -58.22 2.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.82 -59.89 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.444 -177.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -84.59 -5.51 59.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 -179.278 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.75 32.6 74.37 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.204 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 31' ' ' ASN . 4.4 mm -89.77 161.23 2.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.963 0.382 . . . . 0.0 110.986 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' HG22 ' A' ' 30' ' ' ILE . 23.5 m-20 -125.15 -21.13 4.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.524 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.453 ' CB ' HD12 ' A' ' 35' ' ' ILE . 3.8 m-20 -67.2 124.68 23.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.532 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m -82.89 -21.96 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.351 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -43.0 19.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.644 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.453 HD12 ' CB ' ' A' ' 32' ' ' ASP . 62.0 mt -60.85 -43.9 96.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.913 0.387 . . . . 0.0 110.459 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 24' ' ' LEU . 75.9 mt -70.26 -56.78 5.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.583 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -45.59 -27.07 0.69 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.822 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.487 ' HA ' HE21 ' A' ' 37' ' ' GLN . 0.9 OUTLIER -71.43 -39.55 70.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.135 178.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.55 -25.44 65.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.838 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.894 ' C ' HD13 ' A' ' 40' ' ' LEU . 1.2 tm? -72.64 -46.38 54.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.104 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.594 ' N ' HD13 ' A' ' 40' ' ' LEU . 19.8 mmmt -58.64 -31.77 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.658 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.86 -48.33 8.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.607 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 44' ' ' ASN . 88.8 p -63.61 -5.91 4.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.679 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.588 ' OD1' ' O ' ' A' ' 44' ' ' ASN . 5.6 p30 59.51 28.6 18.03 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.28 -11.65 54.92 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.687 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.56 ' OD1' ' OD1' ' A' ' 44' ' ' ASN . 10.8 m120 -85.31 131.88 34.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.054 0.427 . . . . 0.0 110.253 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 50' ' ' ALA . 65.7 tp -81.71 -61.29 1.97 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.211 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.536 ' C ' HD22 ' A' ' 49' ' ' LEU . 1.4 mt-10 -40.89 -25.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.055 0.455 . . . . 0.0 109.81 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.3 mm? -90.05 -35.24 15.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.59 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -63.79 -52.2 61.33 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.79 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.5 p -56.64 -56.48 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.79 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.71 -36.17 56.92 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.462 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -54.19 -31.66 53.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.918 178.922 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.595 HD22 HG21 ' A' ' 28' ' ' THR . 8.0 mp -78.68 -55.36 5.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.222 0 CA-C-O 121.223 0.535 . . . . 0.0 109.687 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 p30 . . . . . 0 C--O 1.232 0.167 0 CA-C-O 120.785 0.326 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 105' ' ' ALA . 5.1 tt -73.02 -50.08 25.13 Favored 'General case' 0 CA--C 1.51 -0.561 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.1 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.656 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.5 mt-30 -46.01 -20.12 0.08 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 178.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.533 ' N ' ' C ' ' A' ' 102' ' ' LEU . 0.8 OUTLIER -87.1 -31.53 20.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.436 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.611 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.1 -57.29 13.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.259 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -74.05 -34.1 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.15 -179.308 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.769 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -61.51 -58.22 9.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.71 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.659 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 36.8 mt -47.27 -44.79 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.781 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.488 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -61.27 -46.2 91.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.056 179.542 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.51 -18.54 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -82.3 -55.47 4.5 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.533 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -45.95 -22.72 0.22 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.45 ' N ' ' C ' ' A' ' 111' ' ' ALA . 19.1 m . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.142 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.7 0.286 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.84 -39.8 62.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.432 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -68.94 -34.08 74.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.68 -70.38 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.768 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.0 pp -39.49 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.798 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.1 m -72.43 -78.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.899 0.381 . . . . 0.0 110.89 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.612 ' CA ' ' HE ' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -25.74 -56.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.324 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 133' ' ' LEU . 7.2 p -57.72 -69.72 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.345 -179.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.991 ' H ' HG13 ' A' ' 132' ' ' VAL . 0.5 OUTLIER -42.34 -54.19 3.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.811 0.338 . . . . 0.0 110.654 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -41.18 -51.5 3.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.598 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.6 -23.58 59.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 133' ' ' LEU . 74.6 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.816 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 . . . . . 0 CA--C 1.523 -0.061 0 CA-C-O 120.763 0.316 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -46.65 -50.95 16.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.397 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.576 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -72.6 -49.33 32.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.194 0.521 . . . . 0.0 110.872 -179.62 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.576 ' N ' ' CG2' ' A' ' 19' ' ' THR . 35.1 t80 -46.46 -58.91 3.32 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.9 mt -66.26 -49.84 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.217 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -45.54 -40.35 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 26' ' ' GLU . 13.2 mm-40 -61.46 -50.09 74.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.765 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.616 HD21 ' CB ' ' A' ' 50' ' ' ALA . 29.9 mt -44.28 -30.95 0.89 Allowed 'General case' 0 C--O 1.226 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.132 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.49 ' CD ' ' C ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -84.59 -18.99 33.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.08 0.467 . . . . 0.0 110.031 179.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.674 ' N ' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -87.4 -55.03 3.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.674 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.513 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -62.27 -59.58 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -177.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -89.15 -3.72 58.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.577 -178.088 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.437 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 66.08 32.68 83.15 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.304 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.681 ' O ' HD11 ' A' ' 36' ' ' LEU . 39.5 mm -106.97 107.48 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 117.449 0.625 . . . . 0.0 110.945 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.659 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -79.91 -20.11 46.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.678 -179.474 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 55.3 m-20 -44.51 84.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.224 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.659 ' N ' ' O ' ' A' ' 31' ' ' ASN . 8.6 t -51.79 -24.47 6.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.866 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.488 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.67 -40.65 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.187 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.488 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 10.7 mt -75.36 -29.41 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.086 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.681 HD11 ' O ' ' A' ' 30' ' ' ILE . 3.2 mt -70.2 -44.81 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.527 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 2.7 pt20 -64.19 -28.75 69.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.386 . . . . 0.0 110.147 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 46.6 tt0 -79.59 -38.29 34.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.05 69.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.503 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -77.06 -40.33 46.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.127 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.732 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.64 -35.64 70.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.7 OUTLIER -86.09 -46.23 10.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.034 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.623 ' O ' ' N ' ' A' ' 45' ' ' GLY . 5.8 m -66.26 18.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.962 0.41 . . . . 0.0 111.01 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.748 HD21 ' ND2' ' A' ' 46' ' ' ASN . 0.8 OUTLIER 31.77 28.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.108 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.623 ' N ' ' O ' ' A' ' 43' ' ' SER . . . 97.5 26.53 9.89 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.945 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.748 ' ND2' HD21 ' A' ' 44' ' ' ASN . 12.7 m-80 -108.68 131.0 55.34 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.513 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.56 -63.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.728 -177.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.575 ' C ' HD22 ' A' ' 49' ' ' LEU . 52.4 tt0 -49.13 -20.83 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.795 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.1 mm? -89.44 -52.57 4.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.486 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.616 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -53.81 -47.77 70.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.684 HG13 ' N ' ' A' ' 52' ' ' ALA . 6.5 p -62.96 -50.71 78.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.119 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.684 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -60.33 -28.72 68.37 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.669 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.502 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.7 OUTLIER -61.91 -37.16 83.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.048 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.551 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -71.4 -57.62 4.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.433 HG22 ' H ' ' A' ' 55' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.936 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.817 0.341 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.649 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.3 mt -66.67 -51.84 51.61 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.012 0.434 . . . . 0.0 110.693 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 102' ' ' LEU . 0.7 OUTLIER -43.82 -18.85 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.6 ' N ' ' O ' ' A' ' 102' ' ' LEU . 3.5 ttp180 -86.76 -35.45 19.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.166 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.649 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -67.39 -47.99 68.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.117 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.759 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.83 -32.81 59.67 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.214 0.531 . . . . 0.0 110.451 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.81 -52.6 23.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.451 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 63.1 tp -46.33 -53.0 11.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.644 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.483 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER -63.79 -46.68 84.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.421 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.04 -17.46 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.95 -58.42 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.782 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -46.23 -22.4 0.23 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.86 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.429 ' N ' ' C ' ' A' ' 111' ' ' ALA . 8.6 t . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.502 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.789 0.328 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.03 -53.12 42.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.74 -39.26 90.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.543 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -63.16 -69.37 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.484 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 128' ' ' ALA . 5.0 mm -37.86 -48.34 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.696 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -60.72 2.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HD2' HH11 ' A' ' 131' ' ' ARG . 3.9 mmt180 -59.08 -55.77 30.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' A' ' 135' ' ' ALA . 82.9 t -48.02 -66.39 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.425 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.75 ' O ' HD23 ' A' ' 133' ' ' LEU . 5.3 tt -34.57 -48.87 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.631 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.551 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -62.51 -30.89 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.5 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.692 -179.915 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 . . . . . 0 N--CA 1.467 0.417 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -46.8 -32.4 3.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.385 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.603 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -69.37 -49.83 51.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.461 0.648 . . . . 0.0 110.081 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.603 ' N ' ' CG2' ' A' ' 19' ' ' THR . 74.9 t80 -60.1 -49.52 77.31 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.604 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -39.55 89.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.16 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -59.25 -39.37 82.63 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.472 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.9 mm100 -56.83 -51.64 68.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.138 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.666 ' HB3' HD22 ' A' ' 36' ' ' LEU . 4.5 mt -45.75 -41.26 10.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.332 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.661 ' NH2' ' OE1' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -69.7 -18.45 63.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.717 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.661 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 1.3 tp10 -85.89 -58.43 2.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.519 ' CD1' ' H ' ' A' ' 27' ' ' ILE . 0.1 OUTLIER -64.43 -59.41 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.493 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -83.24 -2.91 56.77 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.501 -178.734 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 62.7 20.23 61.54 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.032 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.673 HG21 HD21 ' A' ' 36' ' ' LEU . 9.1 mm -65.62 160.36 3.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 117.094 0.447 . . . . 0.0 110.628 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.537 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 5.6 t-20 -117.12 -56.92 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.298 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.474 ' HB3' HD12 ' A' ' 35' ' ' ILE . 1.1 t0 -48.53 111.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.621 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.2 p -71.99 -19.88 61.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.728 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -70.65 -43.08 69.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.594 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' A' ' 32' ' ' ASP . 90.9 mt -62.05 -40.85 88.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.554 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.673 HD21 HG21 ' A' ' 30' ' ' ILE . 16.3 mt -60.45 -62.1 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.451 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -43.41 -28.05 0.32 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.404 ' N ' ' C ' ' A' ' 36' ' ' LEU . 2.1 tp60 -76.09 -38.96 56.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.854 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.558 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.42 -38.07 84.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.075 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -62.29 -37.26 84.85 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.488 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.9 -43.38 94.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.067 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -78.67 -46.07 19.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.147 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.6 p -66.63 -31.57 72.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.307 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 67.3 47.08 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.728 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.587 ' H ' HD22 ' A' ' 40' ' ' LEU . . . 94.15 -14.33 65.52 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.02 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -80.12 124.94 29.21 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 49' ' ' LEU . 32.8 tp -85.02 -62.7 1.48 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.324 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 3.7 tt0 -42.44 -20.87 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.688 HD22 ' N ' ' A' ' 49' ' ' LEU . 4.0 mm? -86.3 -50.19 7.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.608 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.627 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -58.2 -56.82 17.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.647 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 3.7 p -49.67 -46.89 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.647 ' N ' ' CG1' ' A' ' 51' ' ' VAL . . . -60.08 -36.29 77.04 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.401 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -64.39 -36.13 83.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.253 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 50' ' ' ALA . 4.4 mm? -69.34 -57.49 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.179 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 51' ' ' VAL . 9.9 t . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.391 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.594 ' OD2' ' NH2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--O 1.233 0.188 0 CA-C-O 120.749 0.309 . . . . 0.0 110.573 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.843 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -60.57 -35.45 76.09 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 120.53 -0.468 . . . . 0.0 109.793 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.465 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.6 OUTLIER -56.25 -18.69 11.18 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.594 ' NH2' ' OD2' ' A' ' 101' ' ' ASP . 0.4 OUTLIER -82.38 -37.91 24.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.652 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.82 -49.02 76.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.98 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.465 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -62.25 -40.95 89.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 109.75 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.0 -48.15 76.41 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.526 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 108' ' ' LEU . 6.2 tp -55.89 -34.51 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.824 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.462 ' C ' ' N ' ' A' ' 111' ' ' ALA . 58.2 m -78.07 -49.69 13.48 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.575 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -48.06 -18.29 0.18 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.462 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.86 -58.25 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.457 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -46.25 -26.29 0.77 Allowed 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.452 ' N ' ' HG3' ' A' ' 112' ' ' GLU . 35.9 t . . . . . 0 C--N 1.322 -0.612 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.987 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.8 0.333 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 130' ' ' SER . 1.5 tt0 -53.26 -34.22 56.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.598 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.497 ' O ' ' OG ' ' A' ' 130' ' ' SER . 16.6 tt0 -65.91 -55.86 14.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.783 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -45.16 -64.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.6 mp -43.9 -39.36 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.525 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.31 -44.27 83.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 131' ' ' ARG . 7.6 tpt180 -50.33 -36.16 30.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.579 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.9 t -75.37 -62.91 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.49 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.9 mt -44.6 -42.94 7.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -51.57 56.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -74.84 5.61 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.018 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.83 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.451 ' HG2' ' N ' ' A' ' 18' ' ' GLN . 2.4 pt20 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.882 0.373 . . . . 0.0 110.048 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.451 ' N ' ' HG2' ' A' ' 17' ' ' GLN . 5.1 mm-40 -47.13 -56.04 7.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -40.43 66.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.159 0.504 . . . . 0.0 110.326 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -45.47 -63.64 0.91 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.809 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.427 HD22 ' O ' ' A' ' 36' ' ' LEU . 37.8 mt -55.97 -45.12 79.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.253 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 3.4 t-20 -48.56 -43.69 35.85 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.461 0.648 . . . . 0.0 109.43 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.866 ' O ' HD12 ' A' ' 27' ' ' ILE . 6.5 mm100 -60.64 -55.79 29.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.778 HD21 ' HB1' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -43.8 -19.3 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.768 179.612 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -85.31 -25.29 27.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.734 ' N ' ' O ' ' A' ' 23' ' ' GLN . 15.0 tt0 -87.06 -58.14 2.7 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.378 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 1.044 ' H ' HD12 ' A' ' 27' ' ' ILE . 2.4 mp -53.54 -60.7 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.536 ' OG1' HD11 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -88.53 -3.12 58.87 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.663 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.13 32.89 62.59 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.556 HG22 ' H ' ' A' ' 32' ' ' ASP . 27.9 mm -81.58 162.16 3.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.191 0.52 . . . . 0.0 111.725 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.525 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -151.27 33.66 0.58 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.525 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.556 ' H ' HG22 ' A' ' 30' ' ' ILE . 24.6 m-20 -111.6 142.81 43.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.325 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 m -83.03 -39.32 21.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.666 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -78.92 -52.05 8.82 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 35' ' ' ILE . 8.1 mm -57.11 -25.17 22.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.639 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -83.69 -26.68 29.61 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.516 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -81.64 -18.35 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -85.16 -32.24 22.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.513 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB2' HD11 ' A' ' 54' ' ' LEU . . . -74.12 -50.19 20.54 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.93 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.629 ' O ' HD12 ' A' ' 40' ' ' LEU . 4.0 tp -58.0 -41.41 83.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.797 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -61.95 -36.38 81.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.165 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.577 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 1.1 t0 -86.6 -20.16 28.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.152 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.543 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -82.96 -30.36 28.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.898 -179.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.498 ' N ' ' ND2' ' A' ' 44' ' ' ASN . 0.2 OUTLIER 72.9 34.21 1.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.977 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.49 2.15 68.06 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.543 ' O ' ' OG ' ' A' ' 43' ' ' SER . 3.0 m120 -96.61 126.06 41.52 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -79.75 -64.02 1.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.54 -177.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 31.8 tt0 -43.2 -21.44 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.739 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.0 mm? -88.05 -43.83 11.41 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.689 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.778 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -60.21 -55.13 37.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.821 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.4 p -54.53 -57.34 6.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 121.856 0.836 . . . . 0.0 109.063 178.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.821 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -49.86 -42.09 46.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.875 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -52.09 -32.32 34.49 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.626 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 54' ' ' LEU . 7.8 mp -74.44 -57.74 3.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.128 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.348 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.532 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 6.1 t70 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 120.893 0.378 . . . . 0.0 110.421 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.63 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.6 OUTLIER -57.56 -47.87 80.88 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.145 0.497 . . . . 0.0 110.051 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 22.0 tt0 -44.98 -19.8 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.566 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.3 ttt180 -82.76 -37.86 24.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.768 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.63 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.9 -54.77 40.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.526 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -65.56 -36.41 77.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 121.371 0.605 . . . . 0.0 110.594 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -65.21 -40.9 94.77 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.44 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.806 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 6.4 tp -58.21 -45.97 86.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.408 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.9 OUTLIER -66.83 -55.88 12.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.277 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 110' ' ' LEU . 18.4 tp -47.62 -17.9 0.12 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.806 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -76.27 -58.29 3.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.597 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -49.9 -21.28 1.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.868 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.723 0.297 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.8 -35.34 69.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.882 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -81.62 -35.48 30.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.676 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 132' ' ' VAL . . . -71.09 -39.18 72.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.876 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.1 mm -78.0 -40.28 26.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.821 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.5 t -73.7 -22.02 60.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -56.9 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.583 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 128' ' ' ALA . 2.2 p -56.92 -37.54 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.596 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -63.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.456 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 134' ' ' GLU . 0.4 OUTLIER -45.63 -50.51 13.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.439 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.14 -42.52 66.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.675 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.458 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.721 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 1.3 pm0 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.754 0.311 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.662 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 77.4 mt-30 -53.82 -41.47 67.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.517 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -81.06 -44.78 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.148 0.499 . . . . 0.0 110.564 -179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.887 ' CD1' HD12 ' A' ' 40' ' ' LEU . 12.4 t80 -48.79 -60.68 2.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.84 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 37' ' ' GLN . 80.1 mt -58.58 -40.71 83.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -54.18 -40.62 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.646 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.8 mm100 -60.05 -52.96 63.15 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.623 HD21 ' HB1' ' A' ' 50' ' ' ALA . 10.4 mt -44.31 -22.4 0.07 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.208 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.444 ' N ' ' C ' ' A' ' 23' ' ' GLN . 19.3 ttm-85 -86.95 -27.2 23.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.257 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 23' ' ' GLN . 26.4 mt-10 -88.49 -55.75 3.59 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.414 1.265 . . . . 0.0 114.414 -177.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.52 -60.02 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.615 -176.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.576 HG21 HD22 ' A' ' 54' ' ' LEU . 0.4 OUTLIER -84.82 -4.52 59.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.693 -178.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.27 32.49 67.9 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.834 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.872 HD12 HD23 ' A' ' 54' ' ' LEU . 3.5 mt -98.96 145.47 10.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.77 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 33' ' ' THR . 15.0 m-20 -97.33 -44.46 6.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.51 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.82 88.45 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.554 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.575 ' N ' ' O ' ' A' ' 31' ' ' ASN . 19.1 p -60.92 -23.88 65.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.45 -44.75 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.05 0.453 . . . . 0.0 110.237 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.4 mt -73.87 -31.2 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.498 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.681 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.7 mt -70.59 -63.57 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.808 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.532 ' OE1' ' N ' ' A' ' 38' ' ' GLN . 0.0 OUTLIER -47.39 -35.48 8.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.103 0.478 . . . . 0.0 110.369 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 37' ' ' GLN . 3.5 tp60 -73.34 -34.15 65.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.959 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.64 -44.56 95.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.683 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.887 HD12 ' CD1' ' A' ' 20' ' ' PHE . 3.2 tt -62.89 -44.46 96.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.952 0.406 . . . . 0.0 110.579 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.69 -33.55 66.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 m-20 -87.18 -23.35 24.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.888 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 0.3 OUTLIER -88.96 -7.91 55.13 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.026 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.421 ' N ' HD22 ' A' ' 44' ' ' ASN . 3.0 m120 66.27 21.84 10.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.313 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.47 14.54 27.56 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.731 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.639 ' CB ' HD23 ' A' ' 49' ' ' LEU . 4.8 m120 -107.95 127.39 53.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.505 HD22 ' CZ ' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -68.78 -62.81 1.23 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.517 ' C ' HD22 ' A' ' 49' ' ' LEU . 50.5 mt-10 -44.54 -21.69 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.012 0.434 . . . . 0.0 110.702 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.948 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -90.22 -39.44 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.684 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.623 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -64.45 -50.89 65.74 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.697 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.6 p -59.63 -49.43 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.368 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.697 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -61.53 -33.94 74.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.528 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -59.11 -28.35 66.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.287 179.312 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 30' ' ' ILE . 7.7 mp -80.53 -55.11 5.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.436 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 55' ' ' THR . 3.1 t . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.008 0.433 . . . . 0.0 110.126 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 t70 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.796 0.331 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.9 OUTLIER -77.19 -52.98 8.31 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.045 0.45 . . . . 0.0 110.669 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.424 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.3 mp0 -44.25 -18.82 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -85.97 -39.11 17.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.451 -1.249 . . . . 0.0 109.99 179.548 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -50.33 -57.39 8.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.521 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.514 ' H ' HD12 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -65.31 -54.68 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-O 121.566 0.698 . . . . 0.0 110.332 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.51 -60.23 1.83 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.51 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.465 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.4 OUTLIER -47.87 -40.11 20.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.3 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.497 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.1 OUTLIER -68.56 -45.33 72.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.473 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mp -48.46 -19.05 0.28 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.497 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.21 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.226 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -49.39 -19.61 0.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.016 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.414 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.672 0.272 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -53.53 45.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.453 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -64.51 -35.98 82.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.161 179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -59.22 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.175 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 129' ' ' ILE . 9.1 mm -35.76 -40.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.318 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 30.8 t -66.49 -69.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.497 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -42.15 -48.68 4.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.653 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 128' ' ' ALA . 13.7 t -57.22 -62.39 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.673 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.428 ' HA ' HD13 ' A' ' 133' ' ' LEU . 0.2 OUTLIER -41.38 -35.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.461 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -61.97 -49.05 77.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.535 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.07 -17.4 25.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.738 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.6 m . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.499 179.937 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.226 -0.158 0 CA-C-O 120.913 0.387 . . . . 0.0 110.18 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.402 HE21 ' HB3' ' A' ' 18' ' ' GLN . 8.9 mm100 -43.74 -58.33 2.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.09 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.48 -34.43 67.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.451 0.643 . . . . 0.0 110.648 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.603 ' CE2' HD13 ' A' ' 40' ' ' LEU . 1.1 t80 -50.72 -60.61 2.87 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.273 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 17' ' ' GLN . 2.0 mt -66.24 -47.19 74.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.117 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -48.71 -42.75 36.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.144 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -63.16 -53.64 50.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.001 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.645 ' HA ' HD11 ' A' ' 27' ' ' ILE . 26.4 mt -47.91 -26.1 1.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.4 ttm105 -85.38 -19.14 31.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.447 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 23' ' ' GLN . 7.0 tt0 -86.6 -58.53 2.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.859 HD13 ' H ' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -67.24 -54.8 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.548 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.609 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.3 t -87.75 -2.57 58.7 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.588 -176.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 60.83 4.66 4.48 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.622 -0.717 . . . . 0.0 113.67 177.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.573 HG22 ' H ' ' A' ' 32' ' ' ASP . 40.8 mm -65.99 125.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 118.077 0.939 . . . . 0.0 109.961 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.552 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -105.57 30.78 5.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.234 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.573 ' H ' HG22 ' A' ' 30' ' ' ILE . 14.9 m-20 -100.7 88.85 3.71 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.4 m -53.84 -30.41 45.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.895 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -67.7 -51.89 44.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.498 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.81 -22.25 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.566 HD12 HD21 ' A' ' 54' ' ' LEU . 0.7 OUTLIER -73.71 -63.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.584 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -51.8 -27.53 12.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -73.82 -25.27 60.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.456 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.481 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -73.97 -35.37 64.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.006 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.603 HD13 ' CE2' ' A' ' 20' ' ' PHE . 14.1 tp -67.36 -47.75 69.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.399 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -59.78 -41.78 91.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.359 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.471 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -86.34 -15.65 39.85 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.116 -179.391 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.661 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -76.8 -31.21 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.483 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.662 ' OD1' ' ND2' ' A' ' 46' ' ' ASN . 0.5 OUTLIER 84.51 13.51 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.931 -179.529 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.21 13.37 31.26 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.112 -0.565 . . . . 0.0 112.388 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.781 ' HB2' HD22 ' A' ' 49' ' ' LEU . 51.0 m-20 -107.92 130.67 55.01 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' A' ' 50' ' ' ALA . 53.7 tp -86.02 -64.76 1.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -177.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -46.44 -26.33 0.83 Allowed 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.678 0.751 . . . . 0.0 109.276 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -87.19 -29.85 21.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.387 179.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.838 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -74.26 -58.37 3.34 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' N ' ' A' ' 52' ' ' ALA . 14.5 p -43.63 -40.07 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.559 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -67.64 -27.89 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.252 -1.34 . . . . 0.0 110.392 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.696 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -60.0 -28.92 68.1 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.452 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.803 ' N ' HD12 ' A' ' 54' ' ' LEU . 5.6 mp -80.62 -53.51 6.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.299 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 51' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.025 179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 12.3 m-20 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.873 0.368 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.866 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.2 pp -56.03 -46.11 78.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.086 0.469 . . . . 0.0 110.16 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.866 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.14 -19.71 0.08 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.528 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.534 ' N ' ' C ' ' A' ' 102' ' ' LEU . 20.8 ttp85 -85.09 -37.04 20.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.968 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -62.95 -45.3 93.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.314 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.819 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -69.44 -32.66 53.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-O 121.236 0.541 . . . . 0.0 110.537 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.36 -60.29 3.58 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.237 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 30.7 mt -47.24 -42.58 20.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.521 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.454 ' C ' ' N ' ' A' ' 111' ' ' ALA . 81.2 p -72.69 -41.77 64.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.661 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 mt -48.2 -19.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.454 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -89.44 -58.59 2.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.24 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -48.21 -21.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.563 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.402 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.879 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.789 0.328 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -51.24 -48.74 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.7 -25.89 67.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.774 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -66.45 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.75 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.653 ' H ' HD12 ' A' ' 129' ' ' ILE . 2.6 mp -49.35 -33.07 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.845 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' CB ' ' A' ' 134' ' ' GLU . 0.0 OUTLIER -68.73 -25.3 64.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.747 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.5 mmm180 -85.26 -49.59 8.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -54.98 -40.99 56.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.503 ' N ' ' CG1' ' A' ' 132' ' ' VAL . 4.1 tp -80.55 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.544 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 130' ' ' SER . 1.4 tt0 -38.0 -31.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.362 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . -78.62 -52.5 8.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.57 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.804 ' N ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.069 0 CA-C-O 120.75 0.309 . . . . 0.0 110.728 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.65 ' N ' ' OE1' ' A' ' 18' ' ' GLN . 3.8 mp0 -61.52 -58.28 8.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.663 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -73.78 -34.92 64.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.446 0.641 . . . . 0.0 110.213 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' HD23 ' A' ' 40' ' ' LEU . 2.1 t80 -51.89 -60.77 2.79 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.91 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.9 mt -67.72 -31.99 72.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.983 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.481 ' HB3' HE22 ' A' ' 23' ' ' GLN . 1.6 t30 -60.11 -41.87 93.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 0.0 110.147 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.752 ' N ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -67.32 -50.18 61.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.109 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD22 ' A' ' 36' ' ' LEU . 12.6 mt -45.57 -31.82 2.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.33 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.1 ttt-85 -87.61 -20.62 26.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.908 0.385 . . . . 0.0 110.492 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.535 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.1 tt0 -87.58 -58.08 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.553 HD13 ' H ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -62.76 -44.59 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.196 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.553 ' H ' HD13 ' A' ' 27' ' ' ILE . 1.4 t -99.64 -2.68 34.89 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.676 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 63.65 19.33 62.62 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.453 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.525 ' HB ' HD21 ' A' ' 36' ' ' LEU . 7.1 mm -79.12 113.56 18.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.541 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -76.75 -50.77 12.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.788 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.7 m-20 -41.43 103.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.308 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.6 t -71.76 -27.22 62.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.737 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -59.64 -41.71 91.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.518 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.403 HG22 ' CD1' ' A' ' 54' ' ' LEU . 12.8 mm -68.38 -45.84 81.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.705 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.833 HD22 ' HB3' ' A' ' 24' ' ' LEU . 18.2 mt -63.98 -60.75 2.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.189 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 36' ' ' LEU . 4.9 mm-40 -43.46 -29.2 0.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.421 ' N ' ' C ' ' A' ' 36' ' ' LEU . 3.1 tt0 -78.87 -32.28 45.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.083 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -69.64 -33.79 73.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.796 ' C ' HD13 ' A' ' 40' ' ' LEU . 3.0 tm? -66.12 -38.28 87.79 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.093 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -71.13 -42.61 68.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.97 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.56 -24.13 25.57 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.861 0.363 . . . . 0.0 111.481 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.593 ' OG ' ' O ' ' A' ' 39' ' ' ALA . 6.9 p -62.82 -30.3 71.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.778 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.2 t-20 83.66 14.28 0.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.01 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.84 4.97 48.24 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.06 -0.59 . . . . 0.0 111.642 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.62 ' CB ' HD22 ' A' ' 49' ' ' LEU . 2.9 m120 -100.74 130.16 46.74 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.655 ' O ' ' N ' ' A' ' 50' ' ' ALA . 2.1 tt -85.75 -62.84 1.43 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.879 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.522 ' O ' HG13 ' A' ' 51' ' ' VAL . 3.5 mt-10 -41.4 -38.21 1.19 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.093 0.473 . . . . 0.0 110.393 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.959 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -81.13 -26.56 36.04 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.235 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.959 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -69.63 -58.46 3.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 52' ' ' ALA . 1.6 p -44.41 -44.96 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.74 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 177.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.56 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -61.73 -28.62 69.55 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.282 -1.781 . . . . 0.0 110.361 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.641 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -64.32 -29.51 70.59 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.509 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 54' ' ' LEU . 3.1 mm? -75.66 -57.59 3.79 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.287 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.1 t . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.683 179.605 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.1 t0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.916 0.389 . . . . 0.0 110.262 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.642 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.8 OUTLIER -64.86 -52.92 54.02 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.064 0.459 . . . . 0.0 110.325 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.406 ' C ' ' O ' ' A' ' 102' ' ' LEU . 3.9 mm-40 -44.67 -18.33 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.583 ' N ' ' C ' ' A' ' 102' ' ' LEU . 13.5 tpp180 -84.54 -35.5 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.873 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.642 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.91 -40.71 94.19 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.481 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -67.75 -40.32 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.611 0.72 . . . . 0.0 109.772 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.91 75.28 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.214 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.8 OUTLIER -58.84 -41.05 86.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.133 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.458 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.3 m -72.91 -47.89 41.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.225 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.43 -18.58 0.24 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.458 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -84.99 -52.86 5.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.274 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -47.12 -20.96 0.19 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.519 . . . . 0.0 109.74 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.442 ' N ' ' C ' ' A' ' 111' ' ' ALA . 20.1 m . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.039 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE2' ' OE1' ' A' ' 126' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.656 0.265 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.568 ' OE1' ' OE2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -60.89 -31.59 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.988 0.423 . . . . 0.0 110.177 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.43 -37.41 65.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.458 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.06 -65.8 0.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.2 pt -46.68 -32.84 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.411 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -63.02 -37.98 89.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.638 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -65.76 -39.38 91.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.8 t -57.73 -57.69 9.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.635 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.0 mp -48.77 -59.45 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.691 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -52.53 -58.48 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -51.23 -32.49 24.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.85 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 5.7 p . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.86 -179.731 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.884 0.373 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -58.61 7.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.794 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -73.75 -41.26 62.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.334 0.588 . . . . 0.0 110.381 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.625 ' CE1' HD23 ' A' ' 40' ' ' LEU . 19.4 t80 -50.53 -61.02 2.44 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.142 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.674 HD21 ' HA ' ' A' ' 37' ' ' GLN . 17.8 mt -59.25 -49.93 75.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.145 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -44.74 -41.21 6.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.665 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -65.17 -52.48 54.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.866 179.025 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.747 HD21 ' HB1' ' A' ' 50' ' ' ALA . 11.2 mt -43.66 -28.07 0.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.824 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.36 -23.12 24.68 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.131 0.491 . . . . 0.0 109.742 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.665 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -88.02 -56.69 3.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.016 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.14 -59.53 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 121.016 0.436 . . . . 0.0 111.741 -176.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.837 ' OG1' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -81.35 -13.53 58.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.24 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.36 31.97 82.12 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.837 HD13 ' OG1' ' A' ' 28' ' ' THR . 0.4 OUTLIER -90.07 152.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.913 0.387 . . . . 0.0 110.532 -179.065 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -105.15 -39.38 6.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.746 -179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB3' HD12 ' A' ' 35' ' ' ILE . 7.2 m-20 -48.75 85.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.21 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.587 ' N ' ' O ' ' A' ' 31' ' ' ASN . 18.0 p -60.8 -20.21 61.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.012 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -66.99 -49.61 64.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 110.971 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' HB3' ' A' ' 32' ' ' ASP . 3.3 mt -63.82 -31.23 52.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.137 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.638 ' CD2' HD21 ' A' ' 54' ' ' LEU . 8.8 mt -63.59 -61.78 2.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.758 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.674 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -48.7 -27.24 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.245 0.545 . . . . 0.0 109.59 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.491 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 5.1 mt-30 -80.4 -37.95 31.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.372 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.76 97.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.114 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.901 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -62.54 -42.29 99.43 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.713 ' N ' HD13 ' A' ' 40' ' ' LEU . 1.9 mmtp -52.22 -33.39 41.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.908 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.506 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.5 OUTLIER -86.74 -43.87 12.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.599 179.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.599 ' HG ' ' HZ ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -65.63 -29.54 70.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.466 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 43' ' ' SER . 4.4 p30 48.65 53.16 12.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.056 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.38 -9.42 57.49 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.547 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.562 ' O ' ' OG ' ' A' ' 43' ' ' SER . 4.9 m120 -96.0 116.39 28.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.007 0.404 . . . . 0.0 110.198 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -77.41 -63.82 1.29 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.476 -178.492 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.502 ' C ' HD22 ' A' ' 49' ' ' LEU . 24.9 tt0 -42.88 -20.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.743 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.6 mm? -87.69 -52.48 5.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.713 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.747 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -51.1 -47.15 62.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.949 HG13 ' H ' ' A' ' 52' ' ' ALA . 6.5 p -63.21 -62.66 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 CA-C-O 121.517 0.675 . . . . 0.0 109.219 178.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.949 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -47.36 -27.42 1.62 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.236 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -65.74 -38.02 88.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.081 178.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 36' ' ' LEU . 7.8 mp -69.8 -56.65 6.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.261 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.456 HG22 ' H ' ' A' ' 55' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.052 179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.5 t70 . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.726 0.298 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 105' ' ' ALA . 3.0 pp -69.03 -42.09 76.82 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.423 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.582 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.0 tp60 -50.4 -19.38 0.83 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.507 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.1 ttm180 -86.27 -32.65 20.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.398 -1.273 . . . . 0.0 110.003 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -56.47 -56.84 16.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.427 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.678 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.6 OUTLIER -77.53 -33.61 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.318 -179.217 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.59 -59.87 4.32 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.283 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.872 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.8 tp -53.83 -35.68 61.72 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.15 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.514 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.6 t -64.27 -52.62 57.71 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -48.12 -18.58 0.21 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.872 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -72.67 -53.92 10.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.817 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 112' ' ' GLU . 6.3 mm-40 -46.51 -23.08 0.33 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.471 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.88 179.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.758 0.313 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -59.02 -37.98 78.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.601 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -73.36 -38.16 65.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.511 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.35 -54.62 43.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.688 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.427 HG13 ' N ' ' A' ' 130' ' ' SER . 31.7 pt -59.39 -36.32 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.6 m -63.38 -74.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.502 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 130' ' ' SER . 2.3 tpp180 -33.8 -65.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.387 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 133' ' ' LEU . 79.5 t -39.48 -61.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.526 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.456 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER -35.53 -51.74 0.64 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.514 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.567 ' C ' ' H ' ' A' ' 136' ' ' SER . 48.6 mt-10 -63.55 -64.68 0.83 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.579 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.59 9.49 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.721 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.567 ' H ' ' C ' ' A' ' 134' ' ' GLU . 13.5 t . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.635 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.606 0.241 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.457 ' NE2' ' H ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -45.56 -58.37 3.45 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.912 -179.354 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -58.92 -48.15 82.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.058 0.456 . . . . 0.0 111.312 -179.222 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.518 ' N ' ' CG2' ' A' ' 19' ' ' THR . 22.8 t80 -49.3 -59.0 4.09 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.953 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.446 HD13 ' NE2' ' A' ' 37' ' ' GLN . 21.2 mt -61.8 -39.43 91.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.029 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.666 ' OD1' ' NH2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -53.41 -40.81 65.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.647 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.6 mt-30 -59.58 -52.08 67.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.575 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.737 HD11 ' HB1' ' A' ' 50' ' ' ALA . 9.9 mt -44.35 -36.58 2.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.588 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.666 ' NH2' ' OD1' ' A' ' 22' ' ' ASN . 2.1 ttm105 -77.43 -19.26 56.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.715 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.4 tt0 -87.62 -58.59 2.52 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.576 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -60.77 -59.8 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.313 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.704 ' HB ' HG23 ' A' ' 51' ' ' VAL . 0.2 OUTLIER -85.08 -3.08 58.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.42 -178.725 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 60.66 30.81 73.23 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.214 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.488 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 17.1 mm -82.84 147.41 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 117.213 0.507 . . . . 0.0 110.56 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -104.8 -50.67 3.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.99 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -43.36 103.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.548 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 p -68.59 -25.53 64.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.14 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -64.65 -44.86 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.97 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.508 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.8 mp -67.98 -25.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.451 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -69.81 -50.18 45.52 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.877 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.446 ' NE2' HD13 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -59.46 -32.05 69.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.093 -179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -72.74 -38.18 67.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.332 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.783 ' HB2' HD21 ' A' ' 54' ' ' LEU . . . -63.98 -34.7 78.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.746 HD23 ' O ' ' A' ' 40' ' ' LEU . 3.6 tt -65.85 -44.83 84.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.162 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.9 mmtp -59.17 -34.77 72.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.74 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.512 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -86.2 -13.46 46.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.476 ' O ' ' CB ' ' A' ' 44' ' ' ASN . 14.4 m -97.13 -30.34 13.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.315 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.476 ' CB ' ' O ' ' A' ' 43' ' ' SER . 5.7 t30 77.73 24.38 0.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.134 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.12 8.68 47.0 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.438 ' HB3' HD23 ' A' ' 49' ' ' LEU . 94.9 m-20 -97.17 130.95 44.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.576 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -82.54 -63.55 1.35 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.426 -178.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.43 ' C ' HD22 ' A' ' 49' ' ' LEU . 2.6 tt0 -45.44 -21.5 0.1 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 49' ' ' LEU . 3.2 mm? -87.97 -45.64 10.05 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.737 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.931 HG13 ' H ' ' A' ' 52' ' ' ALA . 4.2 p -59.87 -61.13 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.931 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -46.55 -42.33 15.7 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.159 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -52.7 -28.83 23.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.81 178.692 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.783 HD21 ' HB2' ' A' ' 39' ' ' ALA . 6.2 mt -83.18 -49.19 9.72 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.48 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.445 ' H ' HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 121.047 0.451 . . . . 0.0 109.889 179.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.773 0.321 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.592 ' C ' ' N ' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -75.55 -53.41 8.67 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.484 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.429 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -43.91 -19.39 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.592 ' N ' ' C ' ' A' ' 102' ' ' LEU . 9.6 mtp180 -87.22 -39.21 15.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.391 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -52.88 -57.24 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.506 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -64.83 -55.35 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 CA-C-O 121.602 0.715 . . . . 0.0 110.339 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.01 -46.15 5.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.652 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -59.24 -46.52 88.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.848 180.0 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.519 ' C ' ' N ' ' A' ' 111' ' ' ALA . 6.7 t -68.43 -53.21 25.14 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.616 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 tp -47.48 -17.77 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.99 -56.96 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.576 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -46.32 -24.25 0.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.624 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.416 ' N ' ' C ' ' A' ' 111' ' ' ALA . 58.2 m . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.178 179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.583 ' OE1' ' N ' ' A' ' 126' ' ' GLU . 2.4 tm-20 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.851 0.358 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.583 ' N ' ' OE1' ' A' ' 125' ' ' GLU . 20.2 tt0 -48.78 -43.04 37.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.268 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.66 -45.93 92.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.255 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.44 -59.39 4.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.377 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.5 mm -42.78 -55.65 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.781 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.05 -52.09 12.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.736 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -46.6 -48.49 19.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.93 -54.66 28.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.786 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -49.7 -44.29 48.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.68 -61.24 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -41.98 -30.13 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.492 -179.947 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.52 -0.181 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.595 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 4.7 mt-30 -71.64 -25.22 62.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.316 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -71.08 -51.38 25.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.228 0.537 . . . . 0.0 110.484 -179.527 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.595 ' N ' ' CG2' ' A' ' 19' ' ' THR . 42.6 t80 -60.02 -53.92 52.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.032 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 17' ' ' GLN . 13.3 mt -59.8 -45.75 91.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.148 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.595 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -50.05 -49.7 50.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.462 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.601 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.3 mm100 -54.9 -56.05 23.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.92 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 ' HB3' ' A' ' 50' ' ' ALA . 1.1 tp -44.92 -28.79 0.71 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.319 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.59 -24.26 24.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.152 0.501 . . . . 0.0 109.939 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' A' ' 23' ' ' GLN . 62.6 tt0 -88.25 -56.67 3.22 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.54 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -52.88 -59.6 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.427 -176.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.622 HG22 HG23 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -87.2 -6.49 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.742 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.99 9.9 67.33 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.35 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.527 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 2.0 mm -59.43 153.31 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 117.666 0.733 . . . . 0.0 110.287 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.467 ' N ' HG22 ' A' ' 30' ' ' ILE . 4.4 p30 -113.47 -42.74 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.854 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.1 m-20 -44.89 101.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.557 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.9 m -67.13 -31.51 72.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.191 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.434 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.3 OUTLIER -65.02 -37.03 86.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.857 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.434 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 42.8 mm -67.24 -39.75 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.907 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.564 ' HA ' HD23 ' A' ' 24' ' ' LEU . 7.2 mt -61.19 -60.71 3.34 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.378 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -45.61 -32.87 2.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.041 0.448 . . . . 0.0 110.276 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -81.43 -30.48 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.544 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -74.87 -24.11 58.51 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.0 tm? -77.68 -42.6 34.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.009 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -62.2 -43.22 99.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.532 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.598 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 80.4 m-20 -86.19 -22.45 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.707 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -63.93 -30.96 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.629 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.598 ' ND2' ' O ' ' A' ' 42' ' ' ASP . 0.9 OUTLIER 79.88 9.26 1.47 Allowed 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.901 -0.319 . . . . 0.0 110.496 -179.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.15 15.45 25.84 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.516 ' CB ' HD22 ' A' ' 49' ' ' LEU . 0.6 OUTLIER -104.85 131.07 52.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.637 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.54 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.96 -61.07 2.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.006 -178.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.417 ' C ' HG12 ' A' ' 51' ' ' VAL . 5.2 mt-10 -54.01 -25.84 23.25 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 1.179 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -88.53 -25.98 22.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.115 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 1.179 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -79.85 -54.21 6.04 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 55' ' ' THR . 11.6 p -44.11 -40.18 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.595 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -64.9 -33.64 76.5 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.425 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.634 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.7 OUTLIER -54.35 -33.1 58.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.523 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.75 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -87.59 -52.48 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.836 -179.082 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 51' ' ' VAL . 2.8 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.313 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.708 0.289 . . . . 0.0 110.851 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.603 ' C ' HD12 ' A' ' 102' ' ' LEU . 1.1 pp -65.54 -33.2 75.36 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.653 ' HA ' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.69 -19.32 26.23 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.043 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -87.11 -29.22 22.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.166 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.96 -57.8 10.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.239 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.844 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -71.79 -35.31 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.712 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.844 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -57.38 -52.54 64.94 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.2 -38.87 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.557 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.473 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -70.33 -42.89 71.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.232 179.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.4 mp -48.55 -19.14 0.3 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.473 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.1 2.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.406 179.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -47.43 -20.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.942 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.419 ' N ' ' C ' ' A' ' 111' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.007 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.851 0.358 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.34 -40.6 65.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.392 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -25.9 65.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -75.72 -57.48 3.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.702 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.2 mt -53.8 -45.56 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.677 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 131' ' ' ARG . 1.4 t -60.54 -64.97 0.77 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.671 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 130' ' ' SER . 5.7 mtp85 -38.54 -49.95 1.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 128' ' ' ALA . 46.6 t -58.75 -51.32 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.721 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.4 ' O ' ' OG ' ' A' ' 136' ' ' SER . 5.0 mt -43.46 -57.46 3.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.758 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . 0.434 ' C ' ' OE1' ' A' ' 134' ' ' GLU . 11.8 tm-20 -53.11 -57.33 10.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.586 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -50.91 -26.18 5.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 132' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.54 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.402 HE21 HD11 ' A' ' 40' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.887 0.375 . . . . 0.0 110.396 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.498 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.6 OUTLIER -46.59 -41.88 15.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.364 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.425 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -68.04 -40.18 82.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.533 0.682 . . . . 0.0 109.651 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.599 ' CE1' HD22 ' A' ' 47' ' ' LEU . 10.0 t80 -57.82 -56.25 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.934 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.1 mt -64.22 -45.76 86.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.974 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.512 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 14.0 t-20 -46.45 -38.72 9.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -42.99 84.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.741 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.825 ' O ' HG22 ' A' ' 28' ' ' THR . 20.3 mt -54.45 -58.66 6.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -59.03 -18.09 31.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.278 0.561 . . . . 0.0 109.702 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -76.94 -44.73 30.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.288 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.645 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -91.38 -41.31 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.825 HG22 ' O ' ' A' ' 24' ' ' LEU . 3.8 t -95.18 -4.73 45.44 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.941 -177.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.52 31.52 66.99 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.41 -0.424 . . . . 0.0 112.449 178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.71 ' HB ' HD21 ' A' ' 36' ' ' LEU . 47.1 mm -90.07 112.39 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.586 -0.445 . . . . 0.0 110.056 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.511 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 2.5 p30 -76.66 -41.7 44.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.16 90.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.411 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.552 ' HA ' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -58.03 -37.09 73.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.772 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.37 -44.12 84.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.031 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.3 mm -67.88 -28.85 42.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.253 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.728 HD22 ' HB3' ' A' ' 24' ' ' LEU . 96.3 mt -69.33 -51.78 33.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.166 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -53.22 -27.29 21.16 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.47 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.39 -25.18 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.326 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.98 -40.01 32.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.246 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 1.069 HD22 ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.77 -29.7 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.019 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.859 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -69.7 -43.92 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.766 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.47 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.7 m-20 -74.55 -19.31 60.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.776 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.589 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -82.97 -30.79 27.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.928 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.589 ' OD1' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 80.66 23.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.095 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.52 8.63 42.98 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.548 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.1 m120 -96.58 130.75 43.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.688 ' O ' HG12 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -83.46 -63.05 1.43 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.447 ' C ' HD22 ' A' ' 49' ' ' LEU . 21.2 tt0 -45.56 -21.82 0.12 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.698 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.8 mm? -85.87 -42.89 13.72 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.31 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.667 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -61.11 -56.74 17.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 52' ' ' ALA . 1.1 p -50.16 -65.17 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.991 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.83 -42.26 12.14 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.037 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -54.78 -31.11 58.41 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.62 ' CD1' HD22 ' A' ' 24' ' ' LEU . 3.3 mt -87.15 -50.23 6.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.293 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.791 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . 0.426 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.234 0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.281 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 102' ' ' LEU . 4.2 mm? -55.38 -33.77 63.73 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 120.417 -0.513 . . . . 0.0 109.658 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.684 ' HA ' HD11 ' A' ' 106' ' ' ILE . 21.3 tp60 -55.18 -19.74 8.67 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.426 ' CB ' ' O ' ' A' ' 101' ' ' ASP . 23.7 ttt180 -85.92 -32.57 21.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.354 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.68 -57.8 11.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.547 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.684 HD11 ' HA ' ' A' ' 103' ' ' GLN . 0.7 OUTLIER -74.24 -31.86 30.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 CA-C-O 121.087 0.47 . . . . 0.0 111.188 -179.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.15 -52.18 64.86 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.25 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.3 mp -57.83 -38.7 76.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.987 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.503 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -72.36 -54.66 8.8 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.191 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.404 ' HA ' HD22 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -47.49 -17.93 0.11 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.537 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -85.88 -47.72 9.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.301 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.05 -22.53 0.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.461 ' N ' ' C ' ' A' ' 111' ' ' ALA . 62.0 m . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.447 ' CD ' ' N ' ' A' ' 125' ' ' GLU . 1.1 pm0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -54.89 -44.77 74.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.516 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.02 -31.11 72.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.546 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -59.4 -75.67 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.397 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 130' ' ' SER . 18.9 tt -44.58 -45.67 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.319 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.579 ' N ' HG23 ' A' ' 129' ' ' ILE . 4.0 p -57.55 -40.95 79.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.28 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -47.54 63.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.195 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.555 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 21.8 t -56.16 -43.51 76.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.123 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.39 -56.52 16.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.209 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.47 -37.34 56.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.315 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.466 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.562 HG22 ' O ' ' A' ' 2' ' ' THR . 91.5 m -98.31 56.49 1.17 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 3' ' ' VAL . 8.9 p -49.98 126.51 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.618 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.16 40.64 0.35 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.619 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.425 ' O ' ' CB ' ' A' ' 6' ' ' ASN . 1.0 OUTLIER -158.43 -171.59 3.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.549 179.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.425 ' CB ' ' O ' ' A' ' 5' ' ' GLN . 2.3 m-20 166.32 -65.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.401 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.55 ' O ' HG22 ' A' ' 7' ' ' VAL . 0.3 OUTLIER -173.76 103.11 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.491 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.783 HD22 ' C ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -81.22 144.83 31.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.108 0.48 . . . . 0.0 110.761 179.935 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -134.62 98.36 4.04 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.906 -179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 47.65 -143.53 0.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.719 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.3 m 65.55 52.75 1.31 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.379 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.94 -49.58 13.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.519 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.55 -37.83 68.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.179 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -73.62 -26.86 60.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.224 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -57.87 -18.83 25.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.457 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -75.88 -59.16 2.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.957 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.794 ' H ' HE21 ' A' ' 17' ' ' GLN . 0.0 OUTLIER -58.02 -32.96 68.45 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.56 -0.456 . . . . 0.0 109.856 179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -60.43 -54.19 48.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.539 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.623 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -62.73 -51.5 66.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.725 -178.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.623 ' N ' ' CG2' ' A' ' 19' ' ' THR . 55.9 t80 -55.75 -53.02 61.72 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.143 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' A' ' 37' ' ' GLN . 27.9 mt -62.56 -48.45 79.4 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.287 178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -50.22 -43.55 52.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.246 178.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.664 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.4 mt-30 -56.73 -53.54 56.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.103 -0.953 . . . . 0.0 110.087 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 54' ' ' LEU . 11.7 mt -43.29 -35.39 1.47 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 123.336 0.397 . . . . 0.0 110.779 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.6 ttm180 -76.42 -21.41 56.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.174 0.511 . . . . 0.0 109.79 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.664 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.8 tt0 -87.36 -58.49 2.56 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -178.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.537 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -59.18 -59.6 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -177.431 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.528 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.6 OUTLIER -82.65 -2.84 55.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 0.0 110.883 -178.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.42 25.02 59.99 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.768 HG22 ' H ' ' A' ' 32' ' ' ASP . 3.3 mm -69.28 159.78 5.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.131 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.474 ' N ' HG22 ' A' ' 30' ' ' ILE . 17.2 m-20 -132.36 22.25 4.39 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.283 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.768 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -103.85 121.19 42.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.461 ' O ' ' OE1' ' A' ' 37' ' ' GLN . 0.0 OUTLIER -82.07 -26.48 33.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.249 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.407 ' HA ' HE21 ' A' ' 34' ' ' GLN . 2.1 mm-40 -83.96 -46.75 11.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.37 . . . . 0.0 111.151 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.487 HD13 ' N ' ' A' ' 35' ' ' ILE . 6.3 mm -66.8 -20.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.081 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.42 HD21 ' CB ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -74.12 -63.52 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.064 -179.635 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.61 ' HA ' HD21 ' A' ' 21' ' ' LEU . 7.1 pt20 -50.86 -25.0 3.98 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -75.47 -38.99 59.23 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.388 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.408 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -65.34 -19.15 65.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.895 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.485 HD13 ' CE2' ' A' ' 20' ' ' PHE . 12.2 tp -79.14 -52.99 7.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.603 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 mptt -51.81 -33.77 37.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.395 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -27.77 27.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 -179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.59 ' OG ' ' N ' ' A' ' 50' ' ' ALA . 3.6 m -80.51 -30.65 37.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.815 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 61.92 35.05 16.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.289 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.33 4.63 50.04 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.681 179.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.425 ' ND2' ' O ' ' A' ' 43' ' ' SER . 6.6 m-80 -93.8 130.96 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.552 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -84.76 -62.62 1.5 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.71 -178.013 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -52.75 -21.87 4.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.025 0.441 . . . . 0.0 110.289 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -81.49 -54.85 5.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.199 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.59 ' N ' ' OG ' ' A' ' 43' ' ' SER . . . -52.44 -36.75 55.29 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.479 ' O ' HG22 ' A' ' 55' ' ' THR . 1.0 OUTLIER -63.26 -49.53 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-N 114.669 -1.151 . . . . 0.0 109.34 177.697 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.758 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -57.0 -44.13 82.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.785 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -60.55 -24.56 65.48 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.863 -0.735 . . . . 0.0 110.816 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.575 ' CD1' HD22 ' A' ' 24' ' ' LEU . 68.6 mt -87.37 -53.57 4.76 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.744 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.689 ' O ' ' N ' ' A' ' 57' ' ' LYS . 12.9 t -91.06 -38.45 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.758 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 35.12 20.54 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.249 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.689 ' N ' ' O ' ' A' ' 55' ' ' THR . 13.1 mtpp -137.19 -100.42 0.2 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.009 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.753 ' O ' ' HB2' ' A' ' 59' ' ' ALA . 10.4 m120 -108.73 -164.16 0.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.87 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.753 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 156.61 138.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG3' ' N ' ' A' ' 61' ' ' THR . 2.4 ptpt -121.31 -123.64 0.28 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.402 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.829 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 9.0 m -162.13 -37.33 0.0 OUTLIER Pre-proline 0 CA--C 1.531 0.216 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.79 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.829 ' CD ' ' H ' ' A' ' 61' ' ' THR . 12.5 Cg_endo -88.29 16.01 1.97 Allowed 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.895 2.396 . . . . 0.0 111.871 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -57.91 -84.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.685 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.435 ' O ' ' CD ' ' A' ' 64' ' ' GLN . 1.2 tm0? -124.15 100.79 6.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.42 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 67' ' ' THR . 4.9 tp10 -68.15 120.29 14.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.624 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' A' ' 65' ' ' GLU . 6.4 tt0 -37.14 93.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -98.24 -46.88 5.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.989 -179.705 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.432 ' OG1' ' N ' ' A' ' 69' ' ' TYR . 4.2 t -160.71 -179.16 7.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.96 0.409 . . . . 0.0 111.008 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 69' ' ' TYR . 1.6 p90 -157.25 70.18 0.6 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.227 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -148.12 -85.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.649 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.499 ' O ' ' N ' ' A' ' 73' ' ' ALA . 0.0 OUTLIER -96.46 35.02 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.595 ' O ' ' N ' ' A' ' 74' ' ' LEU . 4.4 m 44.23 17.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.545 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.513 ' O ' ' C ' ' A' ' 74' ' ' LEU . . . 42.26 15.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.46 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.595 ' N ' ' O ' ' A' ' 72' ' ' THR . 7.9 tp -28.35 93.75 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.511 ' N ' ' O ' ' A' ' 73' ' ' ALA . 74.4 Cg_endo -80.71 16.43 1.59 Allowed 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.611 2.207 . . . . 0.0 112.008 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 165.51 150.07 6.11 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.603 ' O ' ' CB ' ' A' ' 78' ' ' ASP . 0.0 OUTLIER -100.21 -88.09 0.36 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.78 0.324 . . . . 0.0 110.612 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.603 ' CB ' ' O ' ' A' ' 77' ' ' ASN . 0.1 OUTLIER 152.99 157.6 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.403 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -66.1 125.8 26.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.24 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.564 ' O ' ' C ' ' A' ' 81' ' ' ILE . 0.8 OUTLIER -82.48 -169.9 2.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.303 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.564 ' C ' ' O ' ' A' ' 80' ' ' TYR . 0.8 OUTLIER -22.51 -84.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.867 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -170.78 -170.14 0.86 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 83' ' ' VAL . 0.1 OUTLIER -72.7 179.6 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.605 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -77.34 -51.78 5.93 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m 67.48 70.2 0.36 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.961 0.41 . . . . 0.0 110.499 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -73.89 174.02 9.1 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.654 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.13 141.91 49.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.352 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -95.6 30.5 2.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.66 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 41.2 p -65.59 121.98 16.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -171.25 26.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.013 0.435 . . . . 0.0 110.047 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.612 ' O ' ' O ' ' A' ' 92' ' ' ILE . 14.0 m -99.89 -116.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.039 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.678 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.6 tt 31.33 -161.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.293 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.678 ' N ' HG23 ' A' ' 92' ' ' ILE . 15.1 m-20 -152.42 134.91 15.23 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.076 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.5 mp -75.84 -36.52 59.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.047 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.5 -47.08 6.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.699 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.427 ' O ' ' C ' ' A' ' 97' ' ' ASP . . . 79.34 13.02 83.25 Favored Glycine 0 CA--C 1.525 0.684 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.427 ' C ' ' O ' ' A' ' 96' ' ' GLY . 0.1 OUTLIER 37.85 79.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.823 0.344 . . . . 0.0 110.584 -179.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -121.77 81.5 1.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.431 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -92.94 -1.48 56.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.783 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.65 -15.62 63.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.761 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.448 ' N ' ' OD1' ' A' ' 101' ' ' ASP . 1.0 OUTLIER -51.17 -55.61 17.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.075 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.831 ' C ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -56.12 -35.65 67.32 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.581 -179.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.455 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 2.1 tt0 -53.91 -19.51 4.66 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.441 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.1 ttt180 -86.54 -33.05 20.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.857 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -55.55 -53.97 49.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.159 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.476 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -66.68 -47.33 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 CA-C-O 121.352 0.596 . . . . 0.0 110.573 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.82 -57.34 7.56 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.158 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.517 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -46.59 -44.75 18.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.102 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.467 ' C ' ' N ' ' A' ' 111' ' ' ALA . 8.7 t -63.87 -44.43 93.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.218 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -48.61 -19.02 0.3 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 179.098 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.45 -57.99 2.79 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.65 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -47.77 -18.17 0.14 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.307 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.581 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -90.27 -54.47 4.0 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.627 179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -62.19 3.46 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.102 0.477 . . . . 0.0 109.755 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.581 ' H ' ' C ' ' A' ' 113' ' ' SER . 3.0 mpt_? -118.59 -27.87 5.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.678 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -86.54 -18.52 31.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.905 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.27 174.26 7.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.256 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.637 ' C ' ' H ' ' A' ' 120' ' ' THR . 7.2 mtp85 -127.23 23.77 6.4 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.873 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 64.23 -32.99 0.14 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.637 ' H ' ' C ' ' A' ' 118' ' ' ARG . 28.1 p -70.57 -109.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.17 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . 0.577 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 119.72 -35.45 3.83 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.706 HD13 ' N ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -73.67 -16.15 17.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.782 0.325 . . . . 0.0 110.65 -179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 122' ' ' ILE . 17.0 p 56.02 60.54 3.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.699 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -79.03 3.22 17.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.567 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.416 ' H ' ' HG3' ' A' ' 125' ' ' GLU . 1.9 pp20? -59.98 -39.93 87.37 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.694 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' A' ' 125' ' ' GLU . 1.8 tt0 -55.42 -53.26 58.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.862 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.51 -27.67 57.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.632 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 130' ' ' SER . . . -72.91 -84.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.619 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.544 ' C ' ' O ' ' A' ' 128' ' ' ALA . 2.6 mt -26.9 -39.92 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.77 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.59 ' N ' ' O ' ' A' ' 128' ' ' ALA . 9.1 m -62.43 -68.98 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.645 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.9 tmm_? -43.49 -25.36 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.677 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.621 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 41.7 t -75.42 -62.43 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.643 ' O ' ' N ' ' A' ' 138' ' ' ALA . 14.5 mt -37.55 -56.18 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.76 ' O ' ' N ' ' A' ' 137' ' ' ILE . 39.9 tt0 -56.09 -41.21 74.83 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.875 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -36.4 -61.0 0.54 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.857 ' O ' HG22 ' A' ' 137' ' ' ILE . 0.0 OUTLIER -74.59 -7.75 54.13 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.857 HG22 ' O ' ' A' ' 136' ' ' SER . 7.5 tt 102.53 40.0 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.952 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.643 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . 15.77 -91.84 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.233 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.407 ' O ' ' O ' ' A' ' 137' ' ' ILE . 15.4 tt0 -67.88 -144.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.724 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -157.61 135.7 10.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.605 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -87.7 -83.0 0.21 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.408 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -91.06 90.91 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.528 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.424 ' C ' HD22 ' A' ' 144' ' ' LEU . 27.8 p -46.38 154.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.758 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.754 HD22 ' N ' ' A' ' 144' ' ' LEU . 3.3 mm? -92.59 -159.74 0.69 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.435 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 1.4 tmtm? -75.44 -10.47 59.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.498 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 1.4 mmt85 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.544 -179.911 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 3' ' ' VAL . 2.7 mtt . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.595 ' O ' ' O ' ' A' ' 3' ' ' VAL . 17.4 m -56.99 80.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.412 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.595 ' O ' ' O ' ' A' ' 2' ' ' THR . 48.4 t -42.31 -107.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.701 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.682 ' O ' ' N ' ' A' ' 6' ' ' ASN . 32.1 mm-40 -93.49 -77.97 0.44 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.372 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.593 ' O ' ' CB ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 47.79 -79.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.64 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.682 ' N ' ' O ' ' A' ' 4' ' ' GLU . 3.7 t30 88.88 -174.58 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.336 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.45 ' H ' ' ND2' ' A' ' 6' ' ' ASN . 1.1 m -139.02 143.94 30.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.546 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.66 102.34 4.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.059 0.457 . . . . 0.0 110.448 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.488 ' HG3' ' H ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -50.81 -179.78 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.474 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.558 ' CG ' ' H ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -123.55 -129.52 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.604 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.558 ' H ' ' CG ' ' A' ' 10' ' ' GLN . 77.6 p -125.82 -97.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.567 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.413 ' N ' ' OG ' ' A' ' 11' ' ' SER . . . -47.8 -16.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.731 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.439 ' N ' ' C ' ' A' ' 11' ' ' SER . . . -79.24 -25.89 42.55 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.529 ' CG ' ' N ' ' A' ' 15' ' ' LYS . 8.2 pt20 -84.34 -43.48 14.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.754 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.529 ' N ' ' CG ' ' A' ' 14' ' ' GLN . 10.0 ptmm? -59.77 -27.26 66.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.954 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -79.7 -50.12 11.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.769 0.319 . . . . 0.0 110.941 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -52.89 -40.98 63.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.936 0.398 . . . . 0.0 110.749 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -60.21 -43.34 96.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.12 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.462 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -81.03 -42.06 21.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.215 0.531 . . . . 0.0 110.853 -179.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.462 ' N ' ' CG2' ' A' ' 19' ' ' THR . 29.4 t80 -56.84 -56.86 16.17 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.564 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.0 mt -64.46 -39.91 94.7 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.105 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -56.62 -40.73 75.87 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.07 -47.5 80.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.056 179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.541 HD11 ' HB1' ' A' ' 50' ' ' ALA . 14.7 mt -51.16 -53.57 33.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.179 0.514 . . . . 0.0 110.644 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.668 ' C ' ' HE ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -60.07 -16.57 32.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.26 0.553 . . . . 0.0 109.593 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -82.08 -57.47 3.39 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.542 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -78.27 -46.81 25.32 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -177.365 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.542 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.0 t -92.35 -3.17 55.75 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.665 -177.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.57 ' O ' ' OD1' ' A' ' 31' ' ' ASN . . . 62.72 -7.6 0.25 Allowed Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.829 -0.623 . . . . 0.0 113.708 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.537 HG13 HD23 ' A' ' 54' ' ' LEU . 41.1 mm -59.17 97.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 117.911 0.856 . . . . 0.0 110.301 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.57 ' OD1' ' O ' ' A' ' 29' ' ' GLY . 3.8 m-20 -83.06 36.56 0.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.134 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -106.91 85.56 2.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.9 0.381 . . . . 0.0 110.114 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 59.4 p -43.7 -37.05 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.019 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.93 -47.22 83.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.656 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.7 mp -75.62 -33.08 25.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.657 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.548 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.8 mt -65.35 -63.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -51.3 -28.13 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.097 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -78.21 -39.43 40.59 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.84 82.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.048 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.2 tm? -67.93 -43.05 80.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.79 -40.26 20.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.577 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 3.5 t0 -87.3 -40.19 14.7 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.177 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.602 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -63.87 -24.29 67.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.682 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 1.4 p-10 50.35 42.15 25.59 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.558 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.409 ' C ' HD22 ' A' ' 46' ' ' ASN . . . 102.64 -1.39 49.13 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.063 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.61 HD22 ' N ' ' A' ' 46' ' ' ASN . 0.8 OUTLIER -96.85 122.8 40.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 50' ' ' ALA . 21.6 tp -84.99 -61.79 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.248 -179.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.539 ' C ' HD22 ' A' ' 49' ' ' LEU . 5.3 mt-10 -42.73 -21.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.774 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -89.61 -39.3 13.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.618 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -67.38 -54.83 17.05 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.755 HG13 ' N ' ' A' ' 52' ' ' ALA . 10.1 p -53.46 -53.16 26.32 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.755 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.54 -45.02 66.16 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.455 -1.248 . . . . 0.0 109.586 178.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -49.18 -27.81 3.91 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.636 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 7.2 mp -85.86 -52.42 5.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.737 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.515 ' O ' ' C ' ' A' ' 56' ' ' ALA . 2.6 t -82.27 -45.58 14.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.479 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.689 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -31.25 144.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.363 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.557 ' C ' ' ND2' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.913 0.387 . . . . 0.0 110.635 179.909 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.557 ' ND2' ' C ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -168.9 41.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.154 179.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 70.51 -146.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.407 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.426 ' HE2' ' H ' ' A' ' 61' ' ' THR . 8.8 ttpt -88.0 -137.38 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.434 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.434 ' N ' ' HD3' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -148.47 64.32 7.81 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.154 0.502 . . . . 0.0 110.41 179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 61' ' ' THR . 73.0 Cg_endo -84.27 -101.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.302 -1.88 0 C-N-CA 123.267 2.645 . . . . 0.0 112.163 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.534 ' CD ' ' O ' ' A' ' 63' ' ' GLN . 16.1 tm0? 50.15 64.28 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.621 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 51.03 89.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.525 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -97.34 5.61 49.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.68 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -80.2 -96.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.742 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.418 ' O ' ' OG1' ' A' ' 68' ' ' THR . 21.7 m -40.93 101.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.69 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.956 HG22 ' H ' ' A' ' 69' ' ' TYR . 27.8 m -166.93 -176.68 3.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.306 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.956 ' H ' HG22 ' A' ' 68' ' ' THR . 9.0 p90 -150.64 133.38 15.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.543 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -108.91 -172.4 2.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.328 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -120.73 -6.44 9.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.299 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 17.6 m -87.2 102.39 14.42 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.364 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -171.4 122.85 0.55 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.77 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 56.7 tp -90.11 -27.28 0.32 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.495 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.77 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 39.3 Cg_exo -57.24 55.91 0.04 OUTLIER 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.529 2.153 . . . . 0.0 112.12 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.671 ' N ' ' O ' ' A' ' 74' ' ' LEU . . . -117.49 83.31 0.34 Allowed Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -157.06 139.13 14.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.838 0.351 . . . . 0.0 110.541 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 80' ' ' TYR . 0.3 OUTLIER -122.84 -169.2 1.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.545 179.831 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -139.3 -88.16 0.21 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.577 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 78' ' ' ASP . 8.2 m-85 71.32 160.01 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.974 0.416 . . . . 0.0 110.541 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 20.5 mt 70.65 119.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.478 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 172.18 -25.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.709 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.0 144.5 25.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.648 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.436 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . -115.01 -92.63 1.86 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.541 ' O ' ' O ' ' A' ' 86' ' ' GLN . 0.3 OUTLIER 165.66 65.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.844 0.354 . . . . 0.0 110.69 179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.541 ' O ' ' O ' ' A' ' 85' ' ' SER . 1.8 mt-30 33.96 -157.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.44 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 89' ' ' THR . . . -141.3 150.44 42.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.537 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.525 ' O ' ' OG1' ' A' ' 89' ' ' THR . 5.7 p-10 -57.33 -22.35 41.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.315 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.591 HG23 ' O ' ' A' ' 87' ' ' ALA . 77.7 p 53.55 175.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.528 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.557 ' OD1' ' O ' ' A' ' 89' ' ' THR . 1.5 m120 -171.06 37.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.174 0.512 . . . . 0.0 110.002 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.588 ' O ' ' O ' ' A' ' 92' ' ' ILE . 2.0 m -115.01 -104.02 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.94 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.848 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.4 OUTLIER 30.61 -157.28 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.179 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.848 ' N ' HG23 ' A' ' 92' ' ' ILE . 0.9 OUTLIER 61.64 101.03 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.494 -179.758 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.92 29.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.795 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -128.08 -27.11 2.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.418 ' O ' ' C ' ' A' ' 97' ' ' ASP . . . -69.48 -25.31 75.62 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.418 ' C ' ' O ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -38.3 -59.13 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.819 0.342 . . . . 0.0 110.427 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.41 144.32 42.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.307 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.489 ' CG ' ' N ' ' A' ' 100' ' ' ASP . 0.4 OUTLIER -87.84 -49.76 6.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.528 -179.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.489 ' N ' ' CG ' ' A' ' 99' ' ' LYS . 38.4 t0 -53.37 -21.35 5.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.396 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -47.13 81.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.668 HD22 ' H ' ' A' ' 102' ' ' LEU . 2.4 mm? -73.02 -46.43 52.1 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.118 0.485 . . . . 0.0 109.84 179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -44.99 -20.11 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.538 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.2 ttt-85 -85.69 -45.79 11.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.116 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -53.97 -47.42 71.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.87 179.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 8.2 mm -62.28 -57.86 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 CA-C-O 121.668 0.747 . . . . 0.0 109.924 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -45.31 -44.02 11.2 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.055 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.31 -39.23 66.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.148 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.464 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.7 OUTLIER -73.49 -46.73 46.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.238 179.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.497 HD13 ' HA ' ' A' ' 110' ' ' LEU . 1.6 mm? -48.39 -17.89 0.19 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.464 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -87.99 -58.41 2.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.572 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -47.58 -24.41 0.87 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.557 ' O ' ' N ' ' A' ' 115' ' ' ARG . 46.6 t -87.5 -47.01 9.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.929 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -45.56 -14.81 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.557 ' N ' ' O ' ' A' ' 113' ' ' SER . 1.7 mpt_? -102.83 -37.17 7.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.589 179.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.486 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -96.61 29.08 3.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.545 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.491 ' O ' ' N ' ' A' ' 119' ' ' GLU . 52.1 t80 -102.38 -40.8 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.718 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' A' ' 119' ' ' GLU . 0.9 OUTLIER -33.18 -36.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.623 -179.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.547 ' C ' ' O ' ' A' ' 118' ' ' ARG . 3.0 tt0 27.88 56.67 0.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.554 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 t -54.71 139.45 39.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.676 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -148.76 82.66 0.19 Allowed Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 2.1 tt -119.11 148.65 21.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.775 0.321 . . . . 0.0 110.521 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 81.4 p -60.02 152.98 22.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.492 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -134.89 5.13 3.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.508 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -76.03 -29.59 58.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.492 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.4 -49.65 76.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.631 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.42 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.1 OUTLIER -67.78 -30.33 69.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.521 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.48 73.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.541 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.8 mt -59.76 -58.21 8.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.587 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.91 -37.94 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.497 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -60.66 -56.65 18.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.533 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.44 ' H ' HG23 ' A' ' 132' ' ' VAL . 4.1 t -44.38 -36.01 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.52 ' O ' ' C ' ' A' ' 134' ' ' GLU . 2.4 mp -67.69 -89.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.966 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.693 ' O ' ' N ' ' A' ' 137' ' ' ILE . 31.4 mt-10 -33.58 -49.72 0.31 Allowed 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.592 ' C ' ' H ' ' A' ' 137' ' ' ILE . . . -37.44 -69.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.738 ' C ' HG23 ' A' ' 137' ' ' ILE . 0.1 OUTLIER -68.61 11.21 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.119 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.738 HG23 ' C ' ' A' ' 136' ' ' SER . 0.0 OUTLIER 74.57 43.98 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.41 -179.502 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.61 ' C ' ' O ' ' A' ' 137' ' ' ILE . . . 1.12 -68.15 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.588 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.641 ' N ' ' O ' ' A' ' 137' ' ' ILE . 10.3 mm-40 -87.63 139.34 30.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.939 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.601 ' N ' ' OD1' ' A' ' 140' ' ' ASN . 3.0 p-10 -131.89 51.64 2.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.525 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.5 tttm -70.72 -117.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.515 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.414 ' O ' ' N ' ' A' ' 144' ' ' LEU . . . 40.74 -155.97 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.551 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 42.8 t 58.82 -85.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.643 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.467 ' HA ' HD13 ' A' ' 144' ' ' LEU . 0.7 OUTLIER -58.5 116.21 3.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.426 180.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -161.71 0.59 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.635 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.674 179.935 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.8 mmt . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.59 ' O ' ' O ' ' A' ' 3' ' ' VAL . 0.4 OUTLIER -75.49 167.18 22.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.404 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.59 ' O ' ' O ' ' A' ' 2' ' ' THR . 39.7 t -37.22 -105.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.479 ' N ' HG12 ' A' ' 3' ' ' VAL . 10.4 tt0 -132.72 60.87 1.69 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.592 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -117.51 149.9 39.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.698 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.604 ' O ' ' O ' ' A' ' 7' ' ' VAL . 63.5 m-20 54.11 40.34 31.55 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.941 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.604 ' O ' ' O ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER 21.04 104.94 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.142 179.839 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.942 ' H ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -104.56 2.1 30.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.985 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.648 ' N ' HD22 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -84.27 131.8 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.729 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.602 ' O ' ' C ' ' A' ' 11' ' ' SER . 1.3 tp60 64.55 -12.86 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.799 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.602 ' C ' ' O ' ' A' ' 10' ' ' GLN . 5.3 p 9.41 80.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.474 0.484 . . . . 0.0 111.534 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.16 -17.6 63.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.547 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.93 -34.32 2.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.559 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.33 -18.57 1.02 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.391 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -54.43 -35.8 63.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.672 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -75.83 -58.29 3.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.655 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -52.5 -32.26 39.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.873 0.368 . . . . 0.0 110.425 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -59.89 -55.09 38.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.622 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.601 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -68.51 -48.36 64.6 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.297 0.57 . . . . 0.0 110.313 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.601 ' N ' ' CG2' ' A' ' 19' ' ' THR . 40.0 t80 -47.35 -60.28 2.61 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.972 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 mt -61.86 -52.07 65.64 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.956 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -45.14 -32.83 1.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.692 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -71.87 -48.8 43.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.882 179.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.057 HD21 ' HB1' ' A' ' 50' ' ' ALA . 1.9 mp -45.24 -25.67 0.4 Allowed 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.426 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -88.38 -24.39 23.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.766 178.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.692 ' N ' ' O ' ' A' ' 23' ' ' GLN . 5.6 tm-20 -86.84 -57.77 2.85 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.449 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.35 -59.68 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 120.51 -0.476 . . . . 0.0 111.113 -177.492 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -82.5 -5.14 58.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.787 -179.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.35 32.65 76.01 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.209 -0.519 . . . . 0.0 111.893 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.407 HG22 ' N ' ' A' ' 31' ' ' ASN . 3.1 mm -88.25 153.58 3.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.66 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.589 ' N ' ' OD1' ' A' ' 31' ' ' ASN . 0.8 OUTLIER -108.08 -54.57 2.48 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.907 -179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.618 ' HB2' HD12 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -41.24 101.22 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.353 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.3 m -66.7 -24.81 66.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.164 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -69.04 -51.71 36.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.756 0.312 . . . . 0.0 110.857 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.618 HD12 ' HB2' ' A' ' 32' ' ' ASP . 69.8 mt -53.21 -20.59 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.603 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -80.18 -60.66 2.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.725 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -43.38 -25.2 0.13 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.574 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.22 -39.87 32.11 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.004 179.349 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -63.18 -36.4 83.5 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.817 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.79 HD23 ' O ' ' A' ' 40' ' ' LEU . 7.0 tt -66.57 -40.45 88.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.005 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -52.83 -39.19 62.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.024 0.44 . . . . 0.0 109.891 179.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.574 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.4 m-20 -86.76 -30.0 21.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.248 -179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.502 ' OG ' ' N ' ' A' ' 46' ' ' ASN . 0.1 OUTLIER -79.38 -21.47 45.68 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.083 -179.599 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 40' ' ' LEU . 36.3 m120 62.21 29.85 17.53 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.939 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.45 1.42 53.53 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.502 ' N ' ' OG ' ' A' ' 43' ' ' SER . 5.2 m-20 -88.07 130.65 34.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.641 0.257 . . . . 0.0 110.378 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.478 ' C ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -83.98 -63.39 1.36 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.242 -178.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.562 ' C ' HD22 ' A' ' 49' ' ' LEU . 11.9 mt-10 -45.66 -22.4 0.17 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.42 0.629 . . . . 0.0 109.533 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.799 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.5 mm? -89.71 -41.17 12.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.316 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 1.057 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -63.23 -46.89 84.8 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.803 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.9 p -58.75 -59.12 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.803 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -50.07 -40.19 44.63 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.458 179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.3 OUTLIER -53.93 -32.84 54.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.161 179.096 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.568 HD12 ' O ' ' A' ' 50' ' ' ALA . 5.4 mp -85.76 -51.95 6.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.354 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.616 HG23 ' O ' ' A' ' 51' ' ' VAL . 0.1 OUTLIER -71.74 -50.53 29.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.112 179.834 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.684 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 7.17 -102.83 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.697 0.623 . . . . 0.0 110.922 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.55 ' O ' ' CG ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -75.35 140.79 43.27 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 178.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.55 ' CG ' ' O ' ' A' ' 57' ' ' LYS . 13.4 p30 47.0 -160.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 176.85 47.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.019 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.567 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.0 OUTLIER -157.97 143.15 16.74 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.388 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.7 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 0.2 OUTLIER -174.44 -39.97 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.443 179.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.7 ' CD ' ' H ' ' A' ' 61' ' ' THR . 14.5 Cg_exo -66.32 -22.62 52.71 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.619 2.213 . . . . 0.0 112.23 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.413 ' O ' ' C ' ' A' ' 64' ' ' GLN . 0.0 OUTLIER -65.62 127.77 33.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.66 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.413 ' C ' ' O ' ' A' ' 63' ' ' GLN . 5.6 tt0 38.6 58.05 1.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.569 ' OE1' ' O ' ' A' ' 65' ' ' GLU . 0.4 OUTLIER -86.74 -9.42 55.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.427 179.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.471 ' C ' ' O ' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -34.7 120.64 0.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.357 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.41 ' O ' ' C ' ' A' ' 68' ' ' THR . 0.1 OUTLIER -143.53 -30.95 0.49 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.683 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.41 ' C ' ' O ' ' A' ' 67' ' ' THR . 4.6 m 40.17 77.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.374 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -179.26 74.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.521 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -146.4 -176.03 5.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.52 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -92.16 -108.98 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.401 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.572 ' O ' ' O ' ' A' ' 73' ' ' ALA . 40.8 p -131.7 -4.14 3.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.762 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.579 ' O ' ' O ' ' A' ' 74' ' ' LEU . . . 55.46 143.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.228 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.617 ' C ' ' H ' ' A' ' 76' ' ' GLY . 4.2 tp 31.37 98.9 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.417 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -47.65 -2.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.308 -1.581 0 C-N-CA 122.464 2.11 . . . . 0.0 111.825 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.617 ' H ' ' C ' ' A' ' 74' ' ' LEU . . . 72.5 126.53 0.09 OUTLIER Glycine 0 CA--C 1.524 0.603 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 78' ' ' ASP . 13.1 t-20 -140.98 18.13 2.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.733 0.301 . . . . 0.0 110.525 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.448 ' C ' ' O ' ' A' ' 77' ' ' ASN . 0.7 OUTLIER -35.95 151.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.433 179.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' A' ' 79' ' ' ARG . 14.4 mtp180 -45.95 141.17 3.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.606 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.496 ' O ' ' N ' ' A' ' 82' ' ' SER . 0.2 OUTLIER -122.41 178.32 5.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.025 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.5 mt 65.49 -59.27 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 80' ' ' TYR . 1.2 p 43.88 -155.75 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.449 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.475 ' N ' ' OG ' ' A' ' 82' ' ' SER . 13.9 m -149.6 141.28 17.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.718 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -137.13 -97.55 0.47 Allowed Glycine 0 CA--C 1.526 0.731 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 43.71 64.41 1.27 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 110.561 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.22 -36.08 8.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.435 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.9 137.19 1.84 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.599 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -131.75 89.36 2.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.497 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -129.16 114.43 16.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -161.42 28.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.355 0.598 . . . . 0.0 109.4 179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -121.06 166.76 15.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.922 -179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.802 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.1 tt 179.7 -159.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.365 0.602 . . . . 0.0 110.679 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.802 ' N ' HG23 ' A' ' 92' ' ' ILE . 6.0 m-20 -151.44 -80.02 0.11 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.498 179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 94' ' ' LEU . 0.7 OUTLIER 68.69 -45.74 0.54 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.459 -179.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.64 ' O ' ' N ' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -87.35 -34.52 18.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.502 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' C ' ' O ' ' A' ' 95' ' ' THR . . . 35.42 23.41 0.01 OUTLIER Glycine 0 CA--C 1.526 0.725 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.64 ' N ' ' O ' ' A' ' 95' ' ' THR . 21.7 m-20 60.76 170.18 0.09 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.766 0.317 . . . . 0.0 110.619 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -101.11 125.64 47.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.488 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 8.1 mmtp -89.27 -10.48 46.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.453 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -50.74 -32.35 19.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.438 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -51.26 -46.58 62.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.201 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.609 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.4 tt -71.86 -54.46 10.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.209 0.528 . . . . 0.0 110.292 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.411 ' N ' HD23 ' A' ' 102' ' ' LEU . 26.4 tp60 -43.96 -17.96 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 178.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.599 ' N ' ' C ' ' A' ' 102' ' ' LEU . 3.6 tpt180 -86.69 -37.72 17.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.372 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.609 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -59.93 -38.75 83.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.206 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.483 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.9 OUTLIER -75.06 -37.25 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.555 0.693 . . . . 0.0 110.023 179.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -56.87 14.09 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.123 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.809 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 12.2 tp -48.48 -53.94 16.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.116 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.524 ' OG ' ' O ' ' A' ' 105' ' ' ALA . 0.7 OUTLIER -57.69 -49.28 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.241 -0.436 . . . . 0.0 109.833 179.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.7 mt -48.32 -17.93 0.18 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.809 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.33 -54.55 5.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.612 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.481 ' CD ' ' N ' ' A' ' 112' ' ' GLU . 0.3 OUTLIER -46.6 -23.13 0.35 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.586 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.5 OUTLIER -90.43 -54.52 3.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.903 179.31 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.6 -8.42 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.586 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.9 mpt_? -101.54 -52.22 3.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.872 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -54.13 -31.31 51.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.874 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -49.28 -75.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.477 179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.419 ' CG ' ' O ' ' A' ' 118' ' ' ARG . 5.3 ptm180 -76.6 79.35 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.45 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.699 ' H ' ' CD ' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -79.24 -8.99 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.432 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 0.7 OUTLIER -50.51 124.67 11.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.601 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -152.8 118.84 0.91 Allowed Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.848 -0.901 . . . . 0.0 110.848 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 87.4 mt -121.9 135.06 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 0.0 110.5 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.585 ' O ' ' N ' ' A' ' 125' ' ' GLU . 55.4 m -120.06 -101.1 0.43 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.55 ' C ' ' O ' ' A' ' 123' ' ' THR . 0.0 OUTLIER 25.89 41.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.585 ' N ' ' O ' ' A' ' 123' ' ' THR . 2.3 mm-40 -86.12 -49.18 7.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.681 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -58.31 -36.58 73.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.787 ' H ' HE21 ' A' ' 127' ' ' GLN . 0.0 OUTLIER -77.55 -51.02 11.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.748 -179.792 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -48.83 -44.36 39.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.553 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.41 -62.1 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.508 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.27 -16.84 9.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.813 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.1 ttt-85 -76.03 -52.15 10.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.615 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 48.3 t -64.55 -52.93 48.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.406 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.42 HD22 ' HA ' ' A' ' 133' ' ' LEU . 0.9 OUTLIER -47.69 -52.88 16.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.572 179.902 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -51.64 -52.1 50.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.402 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.37 -13.07 2.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.415 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -111.4 -3.28 15.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.462 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 2.0 tt -96.96 -10.98 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.62 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -91.56 172.99 8.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.501 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' O ' ' O ' ' A' ' 140' ' ' ASN . 0.5 OUTLIER -79.59 126.9 31.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.715 -179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER -55.91 -159.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.63 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.17 -171.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.749 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -102.24 129.27 48.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.6 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 42.0 t -44.71 -75.74 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.437 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.561 ' O ' ' O ' ' A' ' 145' ' ' LYS . 0.3 OUTLIER -122.62 149.84 43.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.556 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.561 ' O ' ' O ' ' A' ' 144' ' ' LEU . 2.6 mtpt 37.85 -166.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.705 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.521 -179.976 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.0 ttt . . . . . 0 N--CA 1.49 1.534 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.561 ' O ' ' C ' ' A' ' 3' ' ' VAL . 0.6 OUTLIER -79.7 -57.01 3.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.772 ' O ' HG13 ' A' ' 3' ' ' VAL . 13.5 p 21.48 82.86 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.117 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' OE1' ' OG1' ' A' ' 2' ' ' THR . 4.6 mp0 -84.83 27.01 0.78 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.386 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.565 ' O ' HD21 ' A' ' 8' ' ' LEU . 3.5 tt0 -112.8 88.38 2.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.665 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.606 ' C ' HG23 ' A' ' 7' ' ' VAL . 0.2 OUTLIER -65.28 -164.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.653 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.606 HG23 ' C ' ' A' ' 6' ' ' ASN . 2.5 t 76.76 -0.75 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.955 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.639 HD12 ' N ' ' A' ' 9' ' ' GLN . 0.4 OUTLIER -113.13 -7.77 13.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.957 -179.886 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.639 ' N ' HD12 ' A' ' 8' ' ' LEU . 1.5 tp-100 -111.32 57.77 0.62 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.875 0.369 . . . . 0.0 110.539 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -168.41 84.46 0.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.588 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.5 p -76.36 -1.12 25.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.578 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.15 -41.66 27.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.696 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -47.18 -25.26 0.86 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.697 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -76.54 -41.76 45.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.651 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 27.6 mttp -82.32 -19.01 40.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.796 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -63.43 -23.57 67.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.994 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -45.64 -22.05 0.15 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.422 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -55.36 -44.98 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.53 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.676 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -69.25 -43.5 73.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.644 -179.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.474 ' CE1' ' HB2' ' A' ' 40' ' ' LEU . 38.3 t80 -50.96 -58.15 6.76 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.431 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.0 mt -64.47 -42.27 96.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.004 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.59 -41.29 41.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.702 ' N ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -60.31 -46.54 89.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.095 179.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' HG22 ' A' ' 28' ' ' THR . 40.9 mt -50.35 -57.95 6.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.231 0.538 . . . . 0.0 109.927 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.429 ' CG ' ' O ' ' A' ' 30' ' ' ILE . 0.1 OUTLIER -60.07 -17.31 38.66 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.209 0.528 . . . . 0.0 109.752 179.333 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.421 ' OE2' HG23 ' A' ' 72' ' ' THR . 23.0 tt0 -78.86 -48.77 14.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.714 -178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.57 HG12 ' N ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -89.86 -46.92 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -178.162 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 24' ' ' LEU . 2.8 t -87.39 -2.84 58.9 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 119.659 -0.817 . . . . 0.0 111.373 -177.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 59.06 32.44 71.07 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.698 178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.598 ' HB ' HD21 ' A' ' 36' ' ' LEU . 40.3 mm -89.77 128.65 41.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.281 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 33' ' ' THR . 1.0 OUTLIER -94.03 -47.94 6.46 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.304 -179.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -41.07 98.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.576 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.415 ' N ' ' O ' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -62.71 -22.32 66.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.353 -179.494 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -77.11 -39.95 47.63 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.732 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.47 HG22 ' CD2' ' A' ' 54' ' ' LEU . 34.2 mm -72.46 -21.26 19.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.604 HD22 ' HB3' ' A' ' 24' ' ' LEU . 87.8 mt -76.0 -63.51 1.3 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.271 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.04 -26.0 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -73.53 -37.45 65.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.632 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.585 ' O ' ' OD1' ' A' ' 42' ' ' ASP . . . -60.37 -42.6 96.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.732 179.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.053 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.68 -36.06 79.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.379 179.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 mmtp -53.44 -41.15 65.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.025 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.7 ' OD1' ' CD2' ' A' ' 53' ' ' PHE . 7.1 p30 -87.25 -23.96 24.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.478 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.583 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.4 OUTLIER -77.52 -7.52 56.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.686 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.692 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 0.5 OUTLIER 56.77 25.22 9.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.214 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.43 ' HA2' HD13 ' A' ' 40' ' ' LEU . . . 102.45 -5.87 52.3 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.58 ' O ' ' OG ' ' A' ' 43' ' ' SER . 5.8 m120 -84.39 131.6 34.67 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.601 ' O ' ' N ' ' A' ' 49' ' ' LEU . 13.2 tp -83.25 -64.11 1.23 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.52 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.458 ' C ' ' O ' ' A' ' 47' ' ' LEU . 1.1 tt0 -42.34 -21.02 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.691 ' CD2' ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -88.0 -45.84 9.86 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 114.153 -1.385 . . . . 0.0 109.844 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.626 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -55.2 -53.06 60.83 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.928 HG13 ' H ' ' A' ' 52' ' ' ALA . 3.9 p -57.19 -62.86 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.558 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.928 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.24 -35.22 3.22 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.242 179.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.7 ' CD2' ' OD1' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -64.35 -30.37 71.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.141 179.027 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.661 HD12 HD22 ' A' ' 24' ' ' LEU . 9.3 mt -87.87 -43.83 11.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.387 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.624 ' O ' ' N ' ' A' ' 57' ' ' LYS . 10.2 t -87.27 -29.79 21.38 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.004 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.886 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . -20.48 -46.74 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.952 0.406 . . . . 0.0 110.859 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.624 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -102.85 135.8 43.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.5 179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -171.97 -170.16 0.73 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.469 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -156.12 -123.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.653 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -103.35 169.71 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.659 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.2 m -164.82 69.83 1.43 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.491 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.637 ' O ' ' N ' ' A' ' 64' ' ' GLN . 72.3 Cg_endo -89.36 -8.94 4.43 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 123.219 2.613 . . . . 0.0 112.096 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -45.95 -6.77 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.649 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.637 ' N ' ' O ' ' A' ' 62' ' ' PRO . 33.2 mt-30 59.46 67.55 0.88 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.511 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.575 ' O ' ' O ' ' A' ' 66' ' ' GLU . 11.7 tt0 -103.78 -83.87 0.48 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.893 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.575 ' O ' ' O ' ' A' ' 65' ' ' GLU . 0.5 OUTLIER 53.59 150.78 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.579 -179.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -135.81 0.86 2.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.836 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.567 ' OG1' ' O ' ' A' ' 68' ' ' THR . 1.5 p 56.0 75.84 0.31 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.556 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.54 ' N ' ' CD1' ' A' ' 69' ' ' TYR . 4.4 p90 -138.43 99.34 3.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.695 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.577 ' O ' ' N ' ' A' ' 72' ' ' THR . 4.0 m-85 -131.7 -65.81 0.74 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.554 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.517 ' C ' ' O ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -30.34 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.604 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.577 ' N ' ' O ' ' A' ' 70' ' ' TYR . 1.6 m -83.91 -59.64 2.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.176 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.57 ' O ' ' O ' ' A' ' 72' ' ' THR . . . 45.13 109.54 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.853 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.3 OUTLIER -131.43 48.42 3.67 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.666 179.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.548 ' O ' ' O ' ' A' ' 76' ' ' GLY . 37.1 Cg_endo -69.88 -18.93 36.17 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.561 2.174 . . . . 0.0 111.836 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.548 ' O ' ' O ' ' A' ' 75' ' ' PRO . . . 25.84 -145.64 0.01 OUTLIER Glycine 0 CA--C 1.523 0.593 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -139.53 116.3 10.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 110.584 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.408 ' O ' ' O ' ' A' ' 79' ' ' ARG . 0.7 OUTLIER -49.06 133.96 17.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.563 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 79' ' ' ARG . 15.2 ttt-85 -61.18 -135.41 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.61 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.467 ' O ' ' O ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -129.76 -163.55 1.31 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.536 -179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.467 ' O ' ' O ' ' A' ' 80' ' ' TYR . 0.9 OUTLIER 58.3 143.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.721 -179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 83' ' ' VAL . 50.1 p -175.42 -132.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.57 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.475 ' N ' ' OG ' ' A' ' 82' ' ' SER . 1.2 m -86.55 -172.61 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.524 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 111.27 53.33 0.54 Allowed Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 98.6 p -135.82 30.17 3.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.769 0.318 . . . . 0.0 110.659 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -96.64 149.31 21.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.356 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.465 ' O ' ' C ' ' A' ' 88' ' ' ASP . . . -98.15 93.43 6.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.755 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.526 ' O ' ' C ' ' A' ' 89' ' ' THR . 1.9 m-20 -35.21 -61.9 0.41 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.473 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.526 ' C ' ' O ' ' A' ' 88' ' ' ASP . 6.4 m 29.94 52.55 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.543 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -165.22 25.58 0.05 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.4 -166.46 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.854 -179.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.865 HG23 ' N ' ' A' ' 93' ' ' ASP . 3.7 tt -170.58 -161.05 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.571 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.865 ' N ' HG23 ' A' ' 92' ' ' ILE . 9.2 m-20 -97.81 125.41 42.64 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.762 -179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.63 ' H ' HD12 ' A' ' 94' ' ' LEU . 0.2 OUTLIER -116.12 6.89 14.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -107.04 -29.11 9.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.443 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -79.49 42.96 2.47 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.817 -0.913 . . . . 0.0 110.817 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -39.84 159.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.64 ' N ' ' OD1' ' A' ' 98' ' ' ASP . 0.3 OUTLIER -85.57 96.05 9.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.41 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.72 -5.78 55.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.66 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -49.36 -20.57 0.69 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -51.62 -49.61 61.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.774 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.588 ' O ' ' N ' ' A' ' 104' ' ' ARG . 1.2 tp -71.37 -53.67 13.35 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.15 0.5 . . . . 0.0 110.696 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.421 ' C ' ' O ' ' A' ' 102' ' ' LEU . 26.1 tp60 -43.83 -18.6 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.588 ' N ' ' O ' ' A' ' 102' ' ' LEU . 1.4 mtp180 -86.64 -38.96 16.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.457 -1.247 . . . . 0.0 110.609 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.581 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -54.28 -57.78 9.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.843 0.354 . . . . 0.0 110.398 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.517 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.64 -57.22 12.69 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.756 0.788 . . . . 0.0 109.868 179.591 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -44.09 -39.61 4.35 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.343 -1.299 . . . . 0.0 110.128 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.65 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.3 OUTLIER -59.15 -44.23 92.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.923 179.482 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.45 ' C ' ' N ' ' A' ' 111' ' ' ALA . 2.7 t -68.4 -48.34 64.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.487 -0.561 . . . . 0.0 109.487 179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.51 -17.25 0.76 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.65 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -80.19 -58.85 2.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.039 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -46.82 -25.81 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.648 ' O ' ' N ' ' A' ' 115' ' ' ARG . 31.9 t -90.75 -43.31 10.18 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.864 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.453 ' C ' ' O ' ' A' ' 113' ' ' SER . 34.8 t-20 -37.25 -23.49 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.638 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.648 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -105.75 -45.14 4.47 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.857 179.302 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.457 ' H ' ' HG2' ' A' ' 115' ' ' ARG . . . -79.07 20.95 0.46 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.679 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.452 ' H ' ' C ' ' A' ' 115' ' ' ARG . 53.8 t80 -117.2 -81.59 0.62 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.786 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.414 ' HG2' ' H ' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -69.26 93.41 0.62 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.648 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -118.31 44.64 2.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.61 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.4 t -75.98 152.63 36.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.542 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 160.03 56.27 0.01 OUTLIER Glycine 0 CA--C 1.525 0.681 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 13.6 tt -75.72 134.41 29.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.799 0.333 . . . . 0.0 110.58 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.547 ' O ' ' C ' ' A' ' 124' ' ' ASP . 0.3 OUTLIER -120.95 -15.93 8.19 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.223 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.547 ' C ' ' O ' ' A' ' 123' ' ' THR . 7.0 p-10 24.06 50.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.9 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.456 ' N ' ' O ' ' A' ' 123' ' ' THR . 0.1 OUTLIER -76.1 -41.03 51.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.248 179.67 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.97 -39.54 74.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.221 179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.513 ' C ' ' CD ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -71.18 -35.71 71.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.907 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.4 -70.98 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.364 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 5.4 mt -44.68 -39.14 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.4 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 t -55.69 -56.69 17.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.412 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 27.7 ttt-85 -52.3 -51.69 57.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.05 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.592 ' O ' ' OG ' ' A' ' 136' ' ' SER . 33.2 t -47.46 -71.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.162 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.513 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.1 OUTLIER -30.03 -68.78 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.317 179.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.619 ' C ' ' H ' ' A' ' 136' ' ' SER . 29.2 tt0 -48.29 -59.85 3.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.717 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -57.18 4.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.694 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.619 ' H ' ' C ' ' A' ' 134' ' ' GLU . 0.8 OUTLIER -113.65 -22.87 10.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.658 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.434 HG13 ' H ' ' A' ' 138' ' ' ALA . 5.4 pt -108.45 -42.74 5.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.434 ' H ' HG13 ' A' ' 137' ' ' ILE . . . 40.75 51.05 3.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.331 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -89.38 126.95 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.824 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -130.29 -92.67 0.43 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.301 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt 52.36 88.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.717 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -52.79 149.26 6.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.244 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -57.87 121.57 10.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.563 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.559 ' O ' ' O ' ' A' ' 145' ' ' LYS . 1.1 mm? -101.58 -53.71 2.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.532 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.559 ' O ' ' O ' ' A' ' 144' ' ' LEU . 12.3 tttp 53.31 150.86 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.828 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.491 ' CB ' ' CZ ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.633 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttp . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.545 ' C ' ' NE2' ' A' ' 5' ' ' GLN . 0.5 OUTLIER -143.2 55.66 1.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.526 179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.596 ' O ' HG22 ' A' ' 3' ' ' VAL . 1.9 p -77.62 88.18 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.299 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 48.44 12.5 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.97 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.797 ' NE2' ' H ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -56.25 149.04 17.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.358 179.856 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.551 ' C ' ' H ' ' A' ' 8' ' ' LEU . 23.3 t-20 179.4 125.54 0.07 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.674 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -67.72 38.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.582 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.698 HD12 ' O ' ' A' ' 8' ' ' LEU . 1.5 tp -35.08 -50.57 0.51 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.229 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -113.54 121.92 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.621 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.421 ' C ' ' H ' ' A' ' 12' ' ' ALA . 0.1 OUTLIER -161.55 1.15 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.464 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.9 p -63.47 -1.48 1.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.556 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.421 ' H ' ' C ' ' A' ' 10' ' ' GLN . . . -77.88 -31.53 51.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.363 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.87 -37.03 63.26 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.652 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.483 ' C ' ' CD ' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -63.21 -18.7 63.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.709 -179.778 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.8 tptm -75.74 -34.43 60.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.513 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.3 t-160 -68.34 -58.67 4.02 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.442 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.653 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 8.6 mp0 -54.22 -26.91 31.09 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 4.4 mm100 -64.19 -56.52 14.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.191 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.606 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -75.53 -47.99 24.46 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.331 0.586 . . . . 0.0 110.533 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.606 ' N ' ' CG2' ' A' ' 19' ' ' THR . 61.4 t80 -46.79 -50.56 18.09 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.204 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.583 HD21 ' HA ' ' A' ' 37' ' ' GLN . 54.0 mt -69.33 -52.02 31.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.157 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 9.5 t30 -45.17 -37.9 4.85 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.635 ' O ' ' N ' ' A' ' 26' ' ' GLU . 1.3 mp0 -61.63 -55.72 27.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.881 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 36' ' ' LEU . 9.0 mt -45.82 -21.87 0.15 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.256 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.427 ' N ' ' C ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -87.9 -23.4 23.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.137 179.275 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.635 ' N ' ' O ' ' A' ' 23' ' ' GLN . 20.6 tt0 -87.53 -58.22 2.66 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.432 HD12 ' O ' ' A' ' 23' ' ' GLN . 0.2 OUTLIER -53.82 -59.89 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.444 -177.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.611 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -84.59 -5.51 59.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.817 -179.278 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.75 32.6 74.37 Favored Glycine 0 CA--C 1.529 0.952 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.204 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.551 HG22 ' N ' ' A' ' 31' ' ' ASN . 4.4 mm -89.77 161.23 2.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.963 0.382 . . . . 0.0 110.986 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' HG22 ' A' ' 30' ' ' ILE . 23.5 m-20 -125.15 -21.13 4.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.524 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.453 ' CB ' HD12 ' A' ' 35' ' ' ILE . 3.8 m-20 -67.2 124.68 23.78 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.532 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 30.0 m -82.89 -21.96 34.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.351 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.65 -43.0 19.17 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.644 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.453 HD12 ' CB ' ' A' ' 32' ' ' ASP . 62.0 mt -60.85 -43.9 96.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.913 0.387 . . . . 0.0 110.459 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 24' ' ' LEU . 75.9 mt -70.26 -56.78 5.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.867 -179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.583 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -45.59 -27.07 0.69 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 179.822 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.487 ' HA ' HE21 ' A' ' 37' ' ' GLN . 0.9 OUTLIER -71.43 -39.55 70.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.135 178.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.561 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.55 -25.44 65.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.591 -0.732 . . . . 0.0 109.838 179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.894 ' C ' HD13 ' A' ' 40' ' ' LEU . 1.2 tm? -72.64 -46.38 54.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.104 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.594 ' N ' HD13 ' A' ' 40' ' ' LEU . 19.8 mmmt -58.64 -31.77 68.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.658 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.86 -48.33 8.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.607 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.57 ' O ' ' CG ' ' A' ' 44' ' ' ASN . 88.8 p -63.61 -5.91 4.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.679 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.588 ' OD1' ' O ' ' A' ' 44' ' ' ASN . 5.6 p30 59.51 28.6 18.03 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 103.28 -11.65 54.92 Favored Glycine 0 CA--C 1.529 0.912 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.687 178.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.56 ' OD1' ' OD1' ' A' ' 44' ' ' ASN . 10.8 m120 -85.31 131.88 34.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 117.054 0.427 . . . . 0.0 110.253 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 50' ' ' ALA . 65.7 tp -81.71 -61.29 1.97 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.211 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.536 ' C ' HD22 ' A' ' 49' ' ' LEU . 1.4 mt-10 -40.89 -25.2 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.055 0.455 . . . . 0.0 109.81 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.934 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.3 mm? -90.05 -35.24 15.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.59 178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -63.79 -52.2 61.33 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.79 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.5 p -56.64 -56.48 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.79 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -52.71 -36.17 56.92 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.462 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -54.19 -31.66 53.52 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.918 178.922 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.595 HD22 HG21 ' A' ' 28' ' ' THR . 8.0 mp -78.68 -55.36 5.24 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.288 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.438 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -81.34 -50.42 9.52 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.223 0.535 . . . . 0.0 109.687 179.33 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.77 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 35.11 -157.7 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.335 178.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.512 ' CB ' ' O ' ' A' ' 56' ' ' ALA . 0.2 OUTLIER 82.6 82.19 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.181 -179.356 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 71.7 30.74 2.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.323 -179.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -130.29 -12.48 4.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.021 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.527 ' O ' ' OG1' ' A' ' 61' ' ' THR . 1.7 tttt -53.97 159.68 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.802 0.334 . . . . 0.0 110.577 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.527 ' OG1' ' O ' ' A' ' 60' ' ' LYS . 34.3 m -171.16 75.75 0.53 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.615 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.428 ' HG2' ' H ' ' A' ' 63' ' ' GLN . 72.9 Cg_endo -84.68 -70.0 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 123.066 2.51 . . . . 0.0 112.14 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.604 ' O ' ' C ' ' A' ' 64' ' ' GLN . 39.1 tt0 46.71 93.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.678 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.604 ' C ' ' O ' ' A' ' 63' ' ' GLN . 1.3 pt20 7.53 87.55 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.497 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.544 ' CG ' ' N ' ' A' ' 66' ' ' GLU . 52.8 tt0 -56.54 166.34 0.93 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.651 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.544 ' N ' ' CG ' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -129.69 88.51 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.661 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 m -104.76 85.53 2.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.5 m -133.49 121.59 22.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.567 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.527 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.2 OUTLIER -120.3 52.27 1.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.151 179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.527 ' C ' ' O ' ' A' ' 69' ' ' TYR . 0.2 OUTLIER -28.86 -62.42 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.454 -179.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.625 ' C ' ' H ' ' A' ' 73' ' ' ALA . 10.9 tt0 -34.61 -66.52 0.17 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.248 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m 66.3 -20.9 0.1 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.638 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.625 ' H ' ' C ' ' A' ' 71' ' ' GLN . . . 57.35 72.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.484 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.54 68.64 80.66 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.499 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -42.57 -40.05 7.3 Favored 'Trans proline' 0 C--N 1.304 -1.775 0 C-N-CA 122.81 2.34 . . . . 0.0 112.028 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 101.5 106.47 2.94 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.638 ' ND2' ' N ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -106.92 -7.46 17.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.844 0.354 . . . . 0.0 110.323 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.527 ' O ' ' O ' ' A' ' 79' ' ' ARG . 0.0 OUTLIER -50.69 175.98 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.694 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.527 ' O ' ' O ' ' A' ' 78' ' ' ASP . 31.2 mtt-85 49.81 110.41 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.761 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.459 ' CD1' ' N ' ' A' ' 80' ' ' TYR . 7.5 m-85 -65.7 -57.32 8.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.421 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.481 ' H ' HD12 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -127.79 -150.36 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.296 179.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.629 ' O ' HG13 ' A' ' 83' ' ' VAL . 29.0 t -141.61 -75.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.51 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 82' ' ' SER . 5.8 m -159.37 124.87 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.516 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -121.42 -104.28 1.89 Allowed Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 177.52 -51.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.844 0.354 . . . . 0.0 110.656 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -95.12 -158.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.652 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -68.03 93.51 0.43 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.657 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.437 ' O ' ' O ' ' A' ' 89' ' ' THR . 5.3 t0 -82.45 49.82 1.52 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.353 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.437 ' O ' ' O ' ' A' ' 88' ' ' ASP . 22.9 m 47.5 97.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.074 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 176.61 37.14 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.242 0.544 . . . . 0.0 109.656 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.437 HG22 ' H ' ' A' ' 91' ' ' VAL . 0.1 OUTLIER -91.22 -179.78 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.227 -179.02 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.857 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.3 OUTLIER 179.69 -159.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.802 179.36 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.857 ' N ' HG23 ' A' ' 92' ' ' ILE . 4.5 t70 90.5 161.29 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.393 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.9 ' H ' HD12 ' A' ' 94' ' ' LEU . 4.7 mp -64.61 -31.85 73.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.71 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.26 -25.78 3.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.67 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.502 ' H ' ' HB3' ' A' ' 93' ' ' ASP . . . 53.16 19.01 7.1 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 98' ' ' ASP . 55.1 t0 -73.25 127.14 31.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.89 0.376 . . . . 0.0 110.557 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 34.4 m-20 -66.16 106.07 1.55 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.726 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 2.5 mtmp? -90.86 -8.77 48.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.477 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.55 -42.34 78.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.051 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -82.35 -21.81 35.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.176 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' A' ' 105' ' ' ALA . 5.1 tt -73.02 -50.08 25.13 Favored 'General case' 0 CA--C 1.51 -0.561 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.1 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.656 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.5 mt-30 -46.01 -20.12 0.08 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 178.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.533 ' N ' ' C ' ' A' ' 102' ' ' LEU . 0.8 OUTLIER -87.1 -31.53 20.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.436 179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.611 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.1 -57.29 13.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.259 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.769 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -74.05 -34.1 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.15 -179.308 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.769 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -61.51 -58.22 9.0 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.71 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.659 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 36.8 mt -47.27 -44.79 23.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.905 -0.588 . . . . 0.0 109.781 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.488 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -61.27 -46.2 91.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.056 179.542 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.51 -18.54 0.25 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 178.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -82.3 -55.47 4.5 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.533 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.474 ' HA ' ' HE ' ' A' ' 115' ' ' ARG . 69.3 mm-40 -45.95 -22.72 0.22 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.69 ' O ' ' N ' ' A' ' 115' ' ' ARG . 19.1 m -90.4 -49.38 6.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.142 179.251 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.435 ' C ' ' O ' ' A' ' 113' ' ' SER . 6.2 t-20 -36.88 -20.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.994 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.69 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.6 OUTLIER -108.43 -33.84 6.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.49 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.543 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -91.8 6.83 44.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.932 0.396 . . . . 0.0 110.143 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.534 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -85.47 179.86 7.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.488 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.693 ' CD ' ' H ' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -41.88 -33.49 0.54 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.652 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.587 ' O ' ' C ' ' A' ' 120' ' ' THR . 8.3 pt-20 24.19 50.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.863 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.604 ' OG1' ' N ' ' A' ' 121' ' ' GLY . 0.0 OUTLIER -10.33 -65.36 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.468 179.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . 0.604 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 74.21 162.84 8.94 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 18.2 tt -58.62 165.18 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.74 0.305 . . . . 0.0 110.386 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 34.8 p -149.82 91.31 1.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.574 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -120.76 -0.98 10.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.667 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.18 -43.58 70.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.576 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.84 -39.8 62.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.432 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -68.94 -34.08 74.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.68 -70.38 0.43 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.768 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 2.0 pp -39.49 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.798 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.1 m -72.43 -78.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.899 0.381 . . . . 0.0 110.89 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.612 ' CA ' ' HE ' ' A' ' 131' ' ' ARG . 0.0 OUTLIER -25.74 -56.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.324 -179.584 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 133' ' ' LEU . 7.2 p -57.72 -69.72 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.345 -179.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.991 ' H ' HG13 ' A' ' 132' ' ' VAL . 0.5 OUTLIER -42.34 -54.19 3.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.811 0.338 . . . . 0.0 110.654 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.498 ' O ' ' HB3' ' A' ' 138' ' ' ALA . 34.2 mm-40 -41.18 -51.5 3.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.598 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.6 -23.58 59.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.799 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 133' ' ' LEU . 74.6 m -86.2 -77.81 0.3 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.816 -179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.493 HG23 ' N ' ' A' ' 138' ' ' ALA . 14.3 tt -43.87 -40.88 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.861 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 134' ' ' GLU . . . -65.28 82.56 0.05 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.916 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -71.03 132.53 45.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.326 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -113.82 143.67 44.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.586 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -124.63 123.77 40.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.557 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.77 -27.42 22.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.468 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.406 ' SG ' ' N ' ' A' ' 144' ' ' LEU . 6.0 t 54.86 -152.6 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.678 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.406 ' N ' ' SG ' ' A' ' 143' ' ' CYS . 15.2 tp 68.08 52.64 0.67 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.791 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -116.69 24.95 10.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.267 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 146' ' ' ARG . 16.5 ttt-85 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.549 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ptm . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.579 ' O ' ' N ' ' A' ' 4' ' ' GLU . 2.0 m -103.68 -10.5 18.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.642 ' O ' HG13 ' A' ' 3' ' ' VAL . 9.8 p 23.24 45.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.059 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.61 ' C ' ' O ' ' A' ' 3' ' ' VAL . 3.5 mt-10 5.1 79.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.582 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.541 ' HG2' HG13 ' A' ' 3' ' ' VAL . 0.5 OUTLIER -65.58 -118.25 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.948 0.404 . . . . 0.0 110.68 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.429 ' OD1' ' C ' ' A' ' 5' ' ' GLN . 4.4 p-10 172.7 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.431 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.423 HG23 ' N ' ' A' ' 8' ' ' LEU . 8.3 m -131.38 -45.04 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.559 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.423 ' N ' HG23 ' A' ' 7' ' ' VAL . 0.7 OUTLIER 177.87 134.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.565 -179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.3 67.59 4.13 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.533 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.54 ' O ' ' C ' ' A' ' 11' ' ' SER . 2.2 pt20 -51.47 162.13 0.4 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.814 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.54 ' C ' ' O ' ' A' ' 10' ' ' GLN . 2.8 p 24.11 85.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.13 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -82.48 -21.4 35.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.863 0.363 . . . . 0.0 110.269 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.63 -47.05 70.72 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.317 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -50.72 -23.32 2.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.566 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -63.59 -18.99 64.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.513 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -56.88 -54.49 45.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.663 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.09 -45.25 61.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.29 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -46.65 -50.95 16.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.397 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.576 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -72.6 -49.33 32.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.194 0.521 . . . . 0.0 110.872 -179.62 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.576 ' N ' ' CG2' ' A' ' 19' ' ' THR . 35.1 t80 -46.46 -58.91 3.32 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.327 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.9 mt -66.26 -49.84 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.217 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -45.54 -40.35 8.51 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.674 ' O ' ' N ' ' A' ' 26' ' ' GLU . 13.2 mm-40 -61.46 -50.09 74.17 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.765 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.616 HD21 ' CB ' ' A' ' 50' ' ' ALA . 29.9 mt -44.28 -30.95 0.89 Allowed 'General case' 0 C--O 1.226 -0.158 0 CA-C-O 120.891 0.376 . . . . 0.0 110.132 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.49 ' CD ' ' C ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -84.59 -18.99 33.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.08 0.467 . . . . 0.0 110.031 179.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.674 ' N ' ' O ' ' A' ' 23' ' ' GLN . 1.0 OUTLIER -87.4 -55.03 3.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.674 -179.192 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.513 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -62.27 -59.58 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -177.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -89.15 -3.72 58.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.577 -178.088 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.437 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 66.08 32.68 83.15 Favored Glycine 0 CA--C 1.532 1.132 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.304 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.681 ' O ' HD11 ' A' ' 36' ' ' LEU . 39.5 mm -106.97 107.48 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 117.449 0.625 . . . . 0.0 110.945 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.659 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.5 OUTLIER -79.91 -20.11 46.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.678 -179.474 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 36' ' ' LEU . 55.3 m-20 -44.51 84.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.224 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.659 ' N ' ' O ' ' A' ' 31' ' ' ASN . 8.6 t -51.79 -24.47 6.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.866 -179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.488 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.1 OUTLIER -74.67 -40.65 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.847 -0.341 . . . . 0.0 111.187 -179.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.488 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 10.7 mt -75.36 -29.41 21.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.086 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.681 HD11 ' O ' ' A' ' 30' ' ' ILE . 3.2 mt -70.2 -44.81 67.93 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.527 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' HG3' ' N ' ' A' ' 38' ' ' GLN . 2.7 pt20 -64.19 -28.75 69.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.91 0.386 . . . . 0.0 110.147 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' A' ' 37' ' ' GLN . 46.6 tt0 -79.59 -38.29 34.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.05 69.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.503 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.89 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -77.06 -40.33 46.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.127 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.732 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -57.64 -35.64 70.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.893 -179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.595 ' C ' ' H ' ' A' ' 44' ' ' ASN . 0.7 OUTLIER -86.09 -46.23 10.64 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.034 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.623 ' O ' ' N ' ' A' ' 45' ' ' GLY . 5.8 m -66.26 18.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.962 0.41 . . . . 0.0 111.01 -179.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.748 HD21 ' ND2' ' A' ' 46' ' ' ASN . 0.8 OUTLIER 31.77 28.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.108 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.623 ' N ' ' O ' ' A' ' 43' ' ' SER . . . 97.5 26.53 9.89 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.945 179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.748 ' ND2' HD21 ' A' ' 44' ' ' ASN . 12.7 m-80 -108.68 131.0 55.34 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.513 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.56 -63.2 1.46 Allowed 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.728 -177.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.575 ' C ' HD22 ' A' ' 49' ' ' LEU . 52.4 tt0 -49.13 -20.83 0.63 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.795 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.1 mm? -89.44 -52.57 4.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.486 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.616 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -53.81 -47.77 70.52 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.684 HG13 ' N ' ' A' ' 52' ' ' ALA . 6.5 p -62.96 -50.71 78.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.119 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.764 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -60.33 -28.72 68.37 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.669 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.502 ' CE2' ' HB3' ' A' ' 42' ' ' ASP . 0.7 OUTLIER -61.91 -37.16 83.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.048 178.986 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.551 ' CD1' ' O ' ' A' ' 50' ' ' ALA . 8.0 mp -71.4 -57.62 4.28 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.605 ' O ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -82.11 -50.58 8.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.936 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.764 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 34.61 26.67 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.884 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.605 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -167.85 -34.64 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.813 0.34 . . . . 0.0 110.492 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.611 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 2.1 t-20 -89.57 -145.99 0.17 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.819 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.611 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 75.92 102.84 0.07 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.629 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.07 -68.19 0.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.115 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.788 ' H ' ' CD ' ' A' ' 62' ' ' PRO . 0.1 OUTLIER -140.78 -42.66 0.02 OUTLIER Pre-proline 0 N--CA 1.466 0.332 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.998 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.788 ' CD ' ' H ' ' A' ' 61' ' ' THR . 9.2 Cg_endo -86.44 56.57 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 C-N-CA 123.193 2.595 . . . . 0.0 111.75 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -130.82 15.04 5.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.677 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -138.33 48.36 1.95 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.436 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -80.31 172.53 13.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.607 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 20.1 mp0 -100.41 131.86 46.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.817 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.2 m -156.12 127.73 7.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.293 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.6 p -120.32 158.33 27.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.681 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.542 ' CE1' ' O ' ' A' ' 70' ' ' TYR . 18.1 t80 179.65 130.65 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.473 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.548 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -125.45 -174.3 3.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.67 -179.861 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.463 ' O ' HG23 ' A' ' 72' ' ' THR . 1.8 tp-100 -103.49 140.82 36.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.464 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.463 HG23 ' O ' ' A' ' 71' ' ' GLN . 23.5 p -155.45 124.08 6.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.637 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.458 ' HB1' ' HD3' ' A' ' 75' ' ' PRO . . . -175.13 160.88 2.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.322 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.528 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.5 OUTLIER -151.98 49.07 0.51 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.792 180.0 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 30.8 Cg_endo -65.9 -9.98 25.15 Favored 'Trans proline' 0 C--N 1.305 -1.742 0 C-N-CA 122.857 2.371 . . . . 0.0 112.2 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -42.03 96.58 0.01 OUTLIER Glycine 0 CA--C 1.524 0.647 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.431 ' N ' ' O ' ' A' ' 75' ' ' PRO . 2.8 t-20 -86.73 163.06 17.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.801 0.334 . . . . 0.0 110.785 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 79' ' ' ARG . 4.8 t0 -169.88 134.28 1.3 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.633 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.633 ' O ' ' CG ' ' A' ' 80' ' ' TYR . 0.0 OUTLIER -138.57 -173.78 3.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.282 179.796 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.633 ' CG ' ' O ' ' A' ' 79' ' ' ARG . 87.6 m-85 -163.01 165.07 25.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.191 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.9 mt 66.46 87.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.433 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 54.7 p -135.03 93.32 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.405 ' H ' HG22 ' A' ' 83' ' ' VAL . 3.4 m -47.99 129.03 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.455 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -164.57 55.05 0.27 Allowed Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.65 29.98 6.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.834 0.35 . . . . 0.0 110.383 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 70.38 -142.47 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.541 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 179.8 130.21 0.09 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.706 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.549 ' O ' ' C ' ' A' ' 89' ' ' THR . 24.4 t0 -162.87 47.09 0.14 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.62 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.549 ' C ' ' O ' ' A' ' 88' ' ' ASP . 3.1 t 24.58 51.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.935 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.413 ' N ' ' O ' ' A' ' 88' ' ' ASP . 2.3 t-20 -174.25 40.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.231 0.538 . . . . 0.0 109.652 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.591 ' O ' ' O ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -115.14 -60.6 2.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.449 -178.821 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.785 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.9 tt -49.13 -161.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.349 0.595 . . . . 0.0 111.206 -178.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.785 ' N ' HG23 ' A' ' 92' ' ' ILE . 11.0 m-20 -27.75 152.1 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.916 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.03 -38.4 10.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.524 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.765 HG23 ' H ' ' A' ' 96' ' ' GLY . 0.6 OUTLIER -74.25 -62.95 1.34 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.534 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.765 ' H ' HG23 ' A' ' 95' ' ' THR . . . 75.18 78.5 0.63 Allowed Glycine 0 CA--C 1.526 0.731 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -68.5 91.26 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.753 0.311 . . . . 0.0 110.565 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -117.15 96.13 5.3 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.631 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.19 -14.38 31.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.632 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.22 -20.6 65.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.761 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -87.83 -44.72 10.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.781 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.649 ' O ' ' N ' ' A' ' 105' ' ' ALA . 7.3 mt -66.67 -51.84 51.61 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.012 0.434 . . . . 0.0 110.693 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.437 ' C ' ' O ' ' A' ' 102' ' ' LEU . 0.7 OUTLIER -43.82 -18.85 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.6 ' N ' ' O ' ' A' ' 102' ' ' LEU . 3.5 ttp180 -86.76 -35.45 19.17 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.166 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.649 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -67.39 -47.99 68.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.117 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.759 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -66.83 -32.81 59.67 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.214 0.531 . . . . 0.0 110.451 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.81 -52.6 23.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.451 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 63.1 tp -46.33 -53.0 11.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.644 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.483 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.5 OUTLIER -63.79 -46.68 84.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.421 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.04 -17.46 0.13 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -86.95 -58.42 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.782 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -46.23 -22.4 0.23 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.86 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.672 ' O ' ' N ' ' A' ' 115' ' ' ARG . 8.6 t -90.04 -50.78 5.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.502 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.445 ' C ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -39.18 -18.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.6 -0.44 . . . . 0.0 109.975 179.885 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.672 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -105.14 -39.65 6.14 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 179.214 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -89.64 31.06 0.96 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.131 179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -125.67 172.08 10.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.833 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.55 ' O ' ' C ' ' A' ' 119' ' ' GLU . 1.8 ptp85 166.29 -43.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.962 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.55 ' C ' ' O ' ' A' ' 118' ' ' ARG . 1.7 tt0 23.26 60.67 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.033 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.7 t -75.82 155.6 35.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.512 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -113.33 -167.64 16.72 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 15.1 tt -140.49 132.91 32.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.768 0.318 . . . . 0.0 110.556 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.499 ' O ' ' CG ' ' A' ' 124' ' ' ASP . 5.3 m -56.72 -65.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.624 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.499 ' CG ' ' O ' ' A' ' 123' ' ' THR . 2.4 m-20 174.41 38.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.327 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 -22.34 66.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.632 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.03 -53.12 42.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.753 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.74 -39.26 90.93 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.543 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.409 ' O ' ' C ' ' A' ' 129' ' ' ILE . . . -63.16 -69.37 0.27 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.484 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.409 ' C ' ' O ' ' A' ' 128' ' ' ALA . 5.0 mm -37.86 -48.34 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.696 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -60.72 2.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HD2' HH11 ' A' ' 131' ' ' ARG . 3.9 mmt180 -59.08 -55.77 30.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.793 -179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' A' ' 135' ' ' ALA . 82.9 t -48.02 -66.39 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.425 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.75 ' O ' HD23 ' A' ' 133' ' ' LEU . 5.3 tt -34.57 -48.87 0.38 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.631 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -63.43 -40.81 98.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.551 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.566 ' N ' ' O ' ' A' ' 132' ' ' VAL . . . -62.51 -30.89 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.588 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.5 m -80.55 -16.21 54.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.692 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.527 ' O ' ' C ' ' A' ' 138' ' ' ALA . 4.5 mm -93.27 -20.62 6.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.757 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.527 ' C ' ' O ' ' A' ' 137' ' ' ILE . . . -29.58 -69.31 0.06 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.353 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.424 ' C ' HD22 ' A' ' 140' ' ' ASN . 0.6 OUTLIER -115.59 32.62 5.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.288 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.424 HD22 ' C ' ' A' ' 139' ' ' GLU . 1.5 m-80 55.8 -130.27 1.91 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.419 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -172.06 118.74 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.477 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -160.34 26.9 0.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.213 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.61 ' O ' ' N ' ' A' ' 145' ' ' LYS . 0.8 OUTLIER 51.48 -167.94 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.315 -179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.472 ' C ' ' O ' ' A' ' 143' ' ' CYS . 1.4 mm? 34.27 28.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.62 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' A' ' 143' ' ' CYS . 0.6 OUTLIER -77.34 152.16 34.6 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.291 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.4 mtm180 . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.505 179.942 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tmm? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.614 ' O ' ' N ' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -129.94 -78.77 0.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.641 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.652 ' O ' HG13 ' A' ' 3' ' ' VAL . 6.3 p 24.3 41.55 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.006 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.614 ' N ' ' O ' ' A' ' 2' ' ' THR . 30.8 tt0 -52.15 143.66 13.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.382 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.408 ' C ' ' O ' ' A' ' 4' ' ' GLU . 19.1 tp60 -39.35 129.25 1.8 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.457 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -138.84 73.43 1.43 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.837 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 34.0 m -108.77 5.32 9.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.511 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 pp -75.49 -21.94 57.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.58 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -80.39 89.73 5.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 -69.14 -164.53 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.572 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.3 32.52 0.52 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.431 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.37 -42.86 29.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.5 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.35 -19.5 64.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.583 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -48.35 -33.73 9.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.003 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.9 ttmm -89.26 -51.92 5.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.92 -60.32 1.99 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 -176.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -84.51 -60.87 1.94 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.03 -0.668 . . . . 0.0 112.763 -177.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -46.8 -32.4 3.65 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.385 -179.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.603 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.6 OUTLIER -69.37 -49.83 51.82 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.461 0.648 . . . . 0.0 110.081 -179.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.603 ' N ' ' CG2' ' A' ' 19' ' ' THR . 74.9 t80 -60.1 -49.52 77.31 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.604 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.6 mt -66.37 -39.55 89.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.16 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -59.25 -39.37 82.63 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.472 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.9 mm100 -56.83 -51.64 68.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.138 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.666 ' HB3' HD22 ' A' ' 36' ' ' LEU . 4.5 mt -45.75 -41.26 10.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.332 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.661 ' NH2' ' OE1' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -69.7 -18.45 63.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.717 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.661 ' OE1' ' NH2' ' A' ' 25' ' ' ARG . 1.3 tp10 -85.89 -58.43 2.65 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -178.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.519 ' CD1' ' H ' ' A' ' 27' ' ' ILE . 0.1 OUTLIER -64.43 -59.41 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -177.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.493 ' CG2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -83.24 -2.91 56.77 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.501 -178.734 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 62.7 20.23 61.54 Favored Glycine 0 CA--C 1.53 0.987 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.032 179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.673 HG21 HD21 ' A' ' 36' ' ' LEU . 9.1 mm -65.62 160.36 3.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 117.094 0.447 . . . . 0.0 110.628 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' N ' ' CG2' ' A' ' 30' ' ' ILE . 5.6 t-20 -117.12 -56.92 2.21 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.298 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.474 ' HB3' HD12 ' A' ' 35' ' ' ILE . 1.1 t0 -48.53 111.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.621 -179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 74.2 p -71.99 -19.88 61.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.728 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -70.65 -43.08 69.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.594 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.474 HD12 ' HB3' ' A' ' 32' ' ' ASP . 90.9 mt -62.05 -40.85 88.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.554 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.673 HD21 HG21 ' A' ' 30' ' ' ILE . 16.3 mt -60.45 -62.1 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.451 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -43.41 -28.05 0.32 Allowed 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' N ' ' C ' ' A' ' 36' ' ' LEU . 2.1 tp60 -76.09 -38.96 56.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.854 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.558 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -67.42 -38.07 84.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.075 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -62.29 -37.26 84.85 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.098 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.488 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -59.9 -43.38 94.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.067 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -78.67 -46.07 19.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.147 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.6 p -66.63 -31.57 72.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.307 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 67.3 47.08 1.35 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.728 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.587 ' H ' HD22 ' A' ' 40' ' ' LEU . . . 94.15 -14.33 65.52 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.02 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -80.12 124.94 29.21 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.619 ' O ' ' N ' ' A' ' 49' ' ' LEU . 32.8 tp -85.02 -62.7 1.48 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.324 -178.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 3.7 tt0 -42.44 -20.87 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.688 HD22 ' N ' ' A' ' 49' ' ' LEU . 4.0 mm? -86.3 -50.19 7.12 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 114.261 -1.336 . . . . 0.0 109.608 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.627 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -58.2 -56.82 17.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.647 ' CG1' ' N ' ' A' ' 52' ' ' ALA . 3.7 p -49.67 -46.89 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.681 ' O ' ' N ' ' A' ' 56' ' ' ALA . . . -60.08 -36.29 77.04 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.401 ' N ' ' O ' ' A' ' 49' ' ' LEU . 0.8 OUTLIER -64.39 -36.13 83.16 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.253 179.197 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 50' ' ' ALA . 4.4 mm? -69.34 -57.49 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.179 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.619 HG23 ' N ' ' A' ' 56' ' ' ALA . 9.9 t -79.29 -48.5 14.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.391 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.681 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . 30.27 -129.67 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.049 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.39 -163.53 0.86 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.536 ' ND2' ' H ' ' A' ' 59' ' ' ALA . 8.8 t-20 -178.7 163.48 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.857 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.536 ' H ' ' ND2' ' A' ' 58' ' ' ASN . . . 67.65 61.08 0.45 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.949 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.531 ' HG2' ' N ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -121.05 -34.07 3.59 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.103 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.531 ' N ' ' HG2' ' A' ' 60' ' ' LYS . 0.0 OUTLIER 167.97 86.6 0.03 OUTLIER Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.074 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.634 ' C ' ' H ' ' A' ' 64' ' ' GLN . 57.5 Cg_endo -88.58 -153.56 0.04 OUTLIER 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 123.146 2.564 . . . . 0.0 111.8 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 61.71 -9.75 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.82 0.343 . . . . 0.0 110.614 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.634 ' H ' ' C ' ' A' ' 62' ' ' PRO . 7.6 mm100 -136.87 56.93 1.78 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -136.69 130.13 31.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.524 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -162.13 111.08 1.45 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.382 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.573 ' O ' ' OG1' ' A' ' 68' ' ' THR . 3.9 t -44.25 110.22 0.2 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.533 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.573 ' OG1' ' O ' ' A' ' 67' ' ' THR . 11.4 m -178.78 -57.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.724 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 61.35 100.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.271 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -73.99 -176.83 2.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.659 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -91.98 133.66 35.51 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.381 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 5.1 p -128.24 -28.84 2.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.472 ' HB1' ' HD3' ' A' ' 75' ' ' PRO . . . -61.3 135.43 57.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.515 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.535 ' N ' ' CD ' ' A' ' 75' ' ' PRO . 0.6 OUTLIER -125.71 49.58 3.71 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.504 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 74' ' ' LEU . 26.9 Cg_endo -65.66 64.03 0.4 Allowed 'Trans proline' 0 C--N 1.304 -1.789 0 C-N-CA 122.69 2.26 . . . . 0.0 112.067 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.523 ' C ' ' O ' ' A' ' 75' ' ' PRO . . . -28.67 118.14 0.06 OUTLIER Glycine 0 CA--C 1.524 0.618 0 N-CA-C 110.931 -0.867 . . . . 0.0 110.931 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.659 HD21 HH21 ' A' ' 79' ' ' ARG . 29.3 t30 -116.95 113.79 22.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.871 0.367 . . . . 0.0 110.625 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -98.86 130.25 45.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.32 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.659 HH21 HD21 ' A' ' 77' ' ' ASN . 3.5 ttm180 -155.84 -34.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.568 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.462 ' O ' HG23 ' A' ' 81' ' ' ILE . 3.4 m-85 64.57 -28.71 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.633 -179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.651 ' H ' ' C ' ' A' ' 79' ' ' ARG . 0.1 OUTLIER -158.72 -176.06 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.29 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.527 ' O ' ' C ' ' A' ' 83' ' ' VAL . 5.0 m -121.8 -173.88 2.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.627 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.527 ' C ' ' O ' ' A' ' 82' ' ' SER . 90.0 t -29.13 111.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.569 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.574 ' C ' ' H ' ' A' ' 86' ' ' GLN . . . -59.41 -49.35 79.51 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.21 -10.19 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.846 0.355 . . . . 0.0 110.496 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.574 ' H ' ' C ' ' A' ' 84' ' ' GLY . 0.0 OUTLIER -150.28 165.29 33.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.459 179.789 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.05 127.88 33.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.586 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -101.47 -16.82 16.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.748 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 t -49.57 161.66 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.512 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -179.49 29.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.316 0.579 . . . . 0.0 109.718 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.678 ' C ' HG22 ' A' ' 92' ' ' ILE . 0.4 OUTLIER -86.46 167.92 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.857 -179.482 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.678 HG22 ' C ' ' A' ' 91' ' ' VAL . 1.3 tt 163.23 165.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.749 179.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.645 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -105.43 143.05 34.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.791 -179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.528 HD12 ' N ' ' A' ' 95' ' ' THR . 1.9 pp -123.07 -33.75 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.667 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.713 HG23 ' H ' ' A' ' 97' ' ' ASP . 9.9 t -94.74 -13.35 25.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.585 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.488 ' O ' ' CB ' ' A' ' 97' ' ' ASP . . . 105.83 -12.7 45.96 Favored Glycine 0 CA--C 1.525 0.716 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.713 ' H ' HG23 ' A' ' 95' ' ' THR . 0.6 OUTLIER 162.26 -83.39 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.667 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -88.01 149.21 24.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.602 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 10.1 ttmm -84.11 -12.78 54.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.536 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -68.78 -21.39 64.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.411 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.594 ' OD2' ' NH2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -54.59 -17.4 3.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.573 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.843 ' O ' HD12 ' A' ' 102' ' ' LEU . 0.2 OUTLIER -60.57 -35.45 76.09 Favored 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 120.53 -0.468 . . . . 0.0 109.793 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.465 ' N ' ' HG ' ' A' ' 102' ' ' LEU . 0.6 OUTLIER -56.25 -18.69 11.18 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 177.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.594 ' NH2' ' OD2' ' A' ' 101' ' ' ASP . 0.4 OUTLIER -82.38 -37.91 24.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.652 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -56.82 -49.02 76.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.98 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.465 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -62.25 -40.95 89.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.555 0.693 . . . . 0.0 109.75 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.0 -48.15 76.41 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.526 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 108' ' ' LEU . 6.2 tp -55.89 -34.51 65.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.824 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.462 ' C ' ' N ' ' A' ' 111' ' ' ALA . 58.2 m -78.07 -49.69 13.48 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.575 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -48.06 -18.29 0.18 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.462 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.86 -58.25 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.457 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -46.25 -26.29 0.77 Allowed 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.546 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.583 ' O ' ' N ' ' A' ' 115' ' ' ARG . 35.9 t -85.21 -43.77 13.5 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.987 179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 113' ' ' SER . 2.8 t-20 -42.42 -18.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.583 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -102.85 -44.65 5.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.24 179.59 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -81.07 11.24 4.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.168 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.47 ' CD2' ' HG3' ' A' ' 118' ' ' ARG . 32.4 t80 -87.51 -104.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.345 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.618 ' O ' ' N ' ' A' ' 120' ' ' THR . 52.6 mtt180 -82.97 40.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.795 0.331 . . . . 0.0 110.481 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.546 ' C ' ' O ' ' A' ' 118' ' ' ARG . 3.7 pt-20 23.73 42.16 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.126 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.618 ' N ' ' O ' ' A' ' 118' ' ' ARG . 1.8 p -47.09 169.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.295 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -164.39 27.36 0.2 Allowed Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.7 tp -42.42 157.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 16.8 p -135.75 151.92 50.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.629 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.03 -84.0 0.66 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.96 -47.95 80.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.605 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.555 ' O ' ' OG ' ' A' ' 130' ' ' SER . 1.5 tt0 -53.26 -34.22 56.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.598 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.497 ' O ' ' OG ' ' A' ' 130' ' ' SER . 16.6 tt0 -65.91 -55.86 14.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.783 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -45.16 -64.49 0.7 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.63 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.6 mp -43.9 -39.36 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.525 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.31 -44.27 83.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 131' ' ' ARG . 7.6 tpt180 -50.33 -36.16 30.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.579 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 10.9 t -75.37 -62.91 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.49 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.556 ' O ' HG22 ' A' ' 137' ' ' ILE . 14.9 mt -44.6 -42.94 7.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.861 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -51.57 56.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -74.84 5.61 4.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.018 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.4 4.08 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.83 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.6 ' O ' ' O ' ' A' ' 138' ' ' ALA . 6.5 tt -145.45 10.84 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.736 0.303 . . . . 0.0 110.761 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.6 ' O ' ' O ' ' A' ' 137' ' ' ILE . . . 21.92 104.96 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.455 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 140' ' ' ASN . 3.9 tp10 -115.4 143.74 44.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.465 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.465 ' CG ' ' H ' ' A' ' 141' ' ' LYS . 33.0 t-20 -132.96 -138.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.684 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.497 ' O ' ' C ' ' A' ' 142' ' ' ALA . 9.1 tttp -149.97 106.78 3.54 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.763 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.497 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . -31.7 109.39 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.729 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 3.2 t -109.35 6.89 24.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.493 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 18.5 mt 66.09 142.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.517 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.0 -153.6 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.398 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.424 ' HD3' HH11 ' A' ' 146' ' ' ARG . 7.8 ttm180 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.627 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mpt? . . . . . 0 N--CA 1.491 1.589 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.55 ' O ' ' NE2' ' A' ' 5' ' ' GLN . 9.1 t -174.28 -36.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.849 0.357 . . . . 0.0 110.472 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.45 HG22 HG23 ' A' ' 2' ' ' THR . 0.1 OUTLIER -82.01 47.54 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.542 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.539 ' O ' ' O ' ' A' ' 5' ' ' GLN . 1.4 tt0 -108.6 -82.62 0.56 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.969 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.642 ' O ' ' ND2' ' A' ' 6' ' ' ASN . 23.0 mm-40 52.55 161.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.642 ' ND2' ' O ' ' A' ' 5' ' ' GLN . 55.6 m-80 -168.1 88.69 0.25 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.46 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.401 HG12 ' N ' ' A' ' 8' ' ' LEU . 50.4 t -128.72 153.45 38.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.514 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.583 ' O ' ' C ' ' A' ' 9' ' ' GLN . 2.1 tt -165.67 163.33 19.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.583 ' C ' ' O ' ' A' ' 8' ' ' LEU . 0.7 OUTLIER -21.9 -64.65 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.115 179.843 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.453 ' CG ' ' O ' ' A' ' 8' ' ' LEU . 4.1 mm-40 40.88 -133.14 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.482 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.448 ' OG ' ' N ' ' A' ' 12' ' ' ALA . 87.4 p -156.74 -66.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.953 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' GLN . . . -54.93 -14.24 1.4 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.158 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -42.53 -19.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.874 -179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' ALA . 40.1 mt-30 -70.61 -40.27 73.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.849 0.357 . . . . 0.0 110.362 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 12' ' ' ALA . 21.4 ttmt -78.6 -18.78 54.03 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.719 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -66.27 -20.85 66.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.963 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.451 ' HG2' ' N ' ' A' ' 18' ' ' GLN . 2.4 pt20 -45.37 -39.68 7.12 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.048 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.451 ' N ' ' HG2' ' A' ' 17' ' ' GLN . 5.1 mm-40 -47.13 -56.04 7.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.584 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -40.43 66.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.159 0.504 . . . . 0.0 110.326 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -45.47 -63.64 0.91 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.809 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.427 HD22 ' O ' ' A' ' 36' ' ' LEU . 37.8 mt -55.97 -45.12 79.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.253 179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 3.4 t-20 -48.56 -43.69 35.85 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.461 0.648 . . . . 0.0 109.43 178.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.866 ' O ' HD12 ' A' ' 27' ' ' ILE . 6.5 mm100 -60.64 -55.79 29.09 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.778 HD21 ' HB1' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -43.8 -19.3 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.768 179.612 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -85.31 -25.29 27.26 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.734 ' N ' ' O ' ' A' ' 23' ' ' GLN . 15.0 tt0 -87.06 -58.14 2.7 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.487 -1.233 . . . . 0.0 113.378 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 1.044 ' H ' HD12 ' A' ' 27' ' ' ILE . 2.4 mp -53.54 -60.7 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.536 ' OG1' HD11 ' A' ' 30' ' ' ILE . 0.5 OUTLIER -88.53 -3.12 58.87 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.663 -179.142 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.13 32.89 62.59 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.556 HG22 ' H ' ' A' ' 32' ' ' ASP . 27.9 mm -81.58 162.16 3.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.191 0.52 . . . . 0.0 111.725 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.525 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -151.27 33.66 0.58 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.525 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.556 ' H ' HG22 ' A' ' 30' ' ' ILE . 24.6 m-20 -111.6 142.81 43.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.325 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 m -83.03 -39.32 21.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.666 -179.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -78.92 -52.05 8.82 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 35' ' ' ILE . 8.1 mm -57.11 -25.17 22.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -178.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.639 HD11 ' HB3' ' A' ' 24' ' ' LEU . 1.0 OUTLIER -83.69 -26.68 29.61 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.516 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -81.64 -18.35 44.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -85.16 -32.24 22.83 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.513 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB2' HD11 ' A' ' 54' ' ' LEU . . . -74.12 -50.19 20.54 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.93 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.629 ' O ' HD12 ' A' ' 40' ' ' LEU . 4.0 tp -58.0 -41.41 83.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.797 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mmmt -61.95 -36.38 81.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.165 179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.577 ' CG ' ' CE1' ' A' ' 53' ' ' PHE . 1.1 t0 -86.6 -20.16 28.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.152 -179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.543 ' OG ' ' O ' ' A' ' 46' ' ' ASN . 0.0 OUTLIER -82.96 -30.36 28.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.898 -179.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.498 ' N ' ' ND2' ' A' ' 44' ' ' ASN . 0.2 OUTLIER 72.9 34.21 1.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.977 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.49 2.15 68.06 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.543 ' O ' ' OG ' ' A' ' 43' ' ' SER . 3.0 m120 -96.61 126.06 41.52 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.566 ' O ' ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -79.75 -64.02 1.28 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 121.09 -0.244 . . . . 0.0 111.54 -177.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' A' ' 52' ' ' ALA . 31.8 tt0 -43.2 -21.44 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.739 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.0 mm? -88.05 -43.83 11.41 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.689 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.778 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -60.21 -55.13 37.5 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.821 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.4 p -54.53 -57.34 6.6 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.521 0 CA-C-O 121.856 0.836 . . . . 0.0 109.063 178.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.821 ' N ' HG13 ' A' ' 51' ' ' VAL . . . -49.86 -42.09 46.75 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.875 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.577 ' CE1' ' CG ' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -52.09 -32.32 34.49 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.626 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 54' ' ' LEU . 7.8 mp -74.44 -57.74 3.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.128 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -77.21 -50.71 12.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.348 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.738 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -50.35 169.24 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.089 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? -117.87 -20.23 8.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.057 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.73 -151.03 0.46 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.345 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -168.08 126.59 1.2 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.848 0.356 . . . . 0.0 110.962 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.4 ttpt -118.77 -138.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.488 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.451 ' N ' ' HD3' ' A' ' 62' ' ' PRO . 20.0 p -147.09 65.27 9.53 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 121.127 0.489 . . . . 0.0 110.684 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.665 ' CD ' HD11 ' A' ' 49' ' ' LEU . 72.9 Cg_endo -87.29 -91.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.301 -1.943 0 C-N-CA 123.524 2.816 . . . . 0.0 112.114 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.406 ' C ' HE21 ' A' ' 64' ' ' GLN . 6.3 tt0 61.81 -17.79 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.287 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.682 ' N ' HE21 ' A' ' 64' ' ' GLN . 0.0 OUTLIER 50.63 54.41 11.24 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.819 -0.353 . . . . 0.0 110.238 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.563 ' C ' ' O ' ' A' ' 64' ' ' GLN . 52.2 tp10 -22.05 107.74 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.951 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.502 ' OE1' ' OG1' ' A' ' 68' ' ' THR . 2.4 tt0 -151.33 150.38 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.805 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.44 ' N ' ' HG2' ' A' ' 66' ' ' GLU . 0.1 OUTLIER -113.86 118.77 35.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.396 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.502 ' OG1' ' OE1' ' A' ' 66' ' ' GLU . 0.3 OUTLIER -137.06 -153.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.627 -179.859 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.677 ' CD2' ' O ' ' A' ' 70' ' ' TYR . 19.3 p90 -166.81 143.39 4.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.549 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.677 ' O ' ' CD2' ' A' ' 69' ' ' TYR . 75.0 m-85 -57.82 -160.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.569 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -123.8 -15.05 7.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.618 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.6 m 43.2 66.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.388 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -115.12 -174.1 2.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' N ' ' HD3' ' A' ' 75' ' ' PRO . 0.7 OUTLIER -141.86 59.85 10.22 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.647 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.537 ' HD3' ' N ' ' A' ' 74' ' ' LEU . 7.3 Cg_exo -66.33 -1.89 6.24 Favored 'Trans proline' 0 C--N 1.302 -1.88 0 C-N-CA 122.37 2.047 . . . . 0.0 112.058 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.9 99.36 2.47 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.605 ' O ' ' CB ' ' A' ' 78' ' ' ASP . 5.2 t-20 -84.19 104.85 14.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.765 0.316 . . . . 0.0 110.526 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.605 ' CB ' ' O ' ' A' ' 77' ' ' ASN . 10.6 t0 89.11 58.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.449 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.515 ' O ' ' O ' ' A' ' 80' ' ' TYR . 1.2 mmt85 -158.93 102.02 1.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.662 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.515 ' O ' ' O ' ' A' ' 79' ' ' ARG . 5.6 m-85 56.1 143.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.78 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER 64.55 56.51 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.8 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.545 ' O ' ' C ' ' A' ' 83' ' ' VAL . 3.4 t -60.55 138.14 58.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.458 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.545 ' C ' ' O ' ' A' ' 82' ' ' SER . 8.6 p -25.94 137.81 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.756 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -92.82 -90.66 1.52 Allowed Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.17 25.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.707 0.289 . . . . 0.0 110.603 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.72 ' O ' ' HB2' ' A' ' 87' ' ' ALA . 25.1 mt-30 -42.17 154.34 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.28 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.72 ' HB2' ' O ' ' A' ' 86' ' ' GLN . . . 160.14 79.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.725 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -73.6 -2.48 23.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.319 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.66 120.05 18.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.595 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.44 ' O ' ' ND2' ' A' ' 90' ' ' ASN . 20.7 t30 -178.78 35.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.169 0.509 . . . . 0.0 109.701 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -115.26 157.78 15.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.343 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.81 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.2 OUTLIER 179.47 -159.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.528 178.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.81 ' N ' HG23 ' A' ' 92' ' ' ILE . 5.8 m-20 -134.47 113.89 12.31 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.863 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.25 -9.23 58.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.486 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.626 ' C ' ' H ' ' A' ' 97' ' ' ASP . 0.1 OUTLIER -131.63 -56.26 1.0 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.588 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.452 ' H ' HG23 ' A' ' 95' ' ' THR . . . 65.2 -27.87 0.12 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.137 -0.785 . . . . 0.0 111.137 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.626 ' H ' ' C ' ' A' ' 95' ' ' THR . 0.0 OUTLIER 179.71 135.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.737 0.303 . . . . 0.0 110.49 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.13 86.45 2.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.46 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -19.64 22.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.102 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.67 -26.78 60.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.607 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.532 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 6.1 t70 -69.28 -54.11 16.35 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.421 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.63 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.6 OUTLIER -57.56 -47.87 80.88 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.145 0.497 . . . . 0.0 110.051 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 22.0 tt0 -44.98 -19.8 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.566 ' N ' ' C ' ' A' ' 102' ' ' LEU . 2.3 ttt180 -82.76 -37.86 24.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.768 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.63 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.9 -54.77 40.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.713 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.526 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -65.56 -36.41 77.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-O 121.371 0.605 . . . . 0.0 110.594 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 103' ' ' GLN . . . -65.21 -40.9 94.77 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.44 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.806 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 6.4 tp -58.21 -45.97 86.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.408 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.524 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.9 OUTLIER -66.83 -55.88 12.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.277 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 110' ' ' LEU . 18.4 tp -47.62 -17.9 0.12 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.806 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -76.27 -58.29 3.37 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.597 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -49.9 -21.28 1.12 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.619 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -88.36 -52.83 4.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.868 179.402 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -43.86 -13.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.619 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -101.31 -40.67 7.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.838 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.485 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -75.88 -14.74 60.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.804 179.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.436 ' O ' ' C ' ' A' ' 118' ' ' ARG . 0.2 OUTLIER -66.65 -62.05 1.66 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.217 179.751 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.607 ' C ' ' H ' ' A' ' 120' ' ' THR . 9.9 mtp180 -36.36 -80.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.61 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 60.74 -6.33 0.09 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.462 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.607 ' H ' ' C ' ' A' ' 118' ' ' ARG . 26.6 p -41.01 136.74 1.41 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.55 179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 135.64 80.97 0.12 Allowed Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.506 HG23 ' OG1' ' A' ' 123' ' ' THR . 11.9 tt -167.59 176.12 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.9 0.381 . . . . 0.0 110.484 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.506 ' OG1' HG23 ' A' ' 122' ' ' ILE . 0.7 OUTLIER 53.22 50.11 18.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.585 179.949 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -64.36 118.95 9.44 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.423 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.48 -38.02 17.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.933 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -71.8 -35.34 69.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.882 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -81.62 -35.48 30.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.676 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 132' ' ' VAL . . . -71.09 -39.18 72.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.876 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.1 mm -78.0 -40.28 26.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.821 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.5 t -73.7 -22.02 60.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.802 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.65 -56.9 4.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.583 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 128' ' ' ALA . 2.2 p -56.92 -37.54 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.596 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.72 -63.55 1.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.456 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 134' ' ' GLU . 0.4 OUTLIER -45.63 -50.51 13.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.439 179.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -53.14 -42.52 66.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.675 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 6.6 m -70.26 -72.22 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.458 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.445 ' O ' ' HB3' ' A' ' 138' ' ' ALA . 2.0 pt -50.76 -22.66 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.372 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 137' ' ' ILE . . . 66.51 -162.76 0.24 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.526 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -90.34 93.89 9.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.521 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -148.69 114.48 5.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.281 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.681 ' O ' ' N ' ' A' ' 143' ' ' CYS . 2.7 mttp -98.52 -81.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.465 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.455 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . 35.58 -85.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.562 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.681 ' N ' ' O ' ' A' ' 141' ' ' LYS . 0.7 OUTLIER -163.27 -79.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.461 179.887 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.559 HD23 ' N ' ' A' ' 145' ' ' LYS . 0.9 OUTLIER -178.47 -3.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.376 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.559 ' N ' HD23 ' A' ' 144' ' ' LEU . 8.0 mtpp 57.98 -179.84 0.06 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.661 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.622 -179.943 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.562 ' O ' ' OG1' ' A' ' 2' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.619 ' C ' ' H ' ' A' ' 4' ' ' GLU . 20.3 p 60.98 89.66 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.646 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.655 ' O ' HG22 ' A' ' 3' ' ' VAL . 4.9 p -52.91 -0.1 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.964 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.619 ' H ' ' C ' ' A' ' 2' ' ' THR . 2.9 mm-40 -32.17 109.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.545 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -83.17 74.65 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.75 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -47.08 137.9 7.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.384 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.6 m -132.66 147.0 31.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.802 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -85.03 -5.64 59.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.329 179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.436 ' C ' ' H ' ' A' ' 11' ' ' SER . 25.0 tp60 -86.59 15.01 5.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.315 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.446 ' HG3' ' H ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -69.76 6.25 1.22 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.526 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.436 ' H ' ' C ' ' A' ' 9' ' ' GLN . 19.3 p -132.53 65.88 1.57 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.77 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.454 ' O ' ' N ' ' A' ' 14' ' ' GLN . . . -62.37 -23.02 66.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.294 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -44.42 -19.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.818 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.454 ' N ' ' O ' ' A' ' 12' ' ' ALA . 1.8 mm100 -47.92 -42.31 26.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.017 -179.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -84.51 -18.58 35.31 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.706 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.402 ' C ' ' N ' ' A' ' 18' ' ' GLN . 0.2 OUTLIER -88.17 -25.98 22.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.314 -179.668 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.721 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 1.3 pm0 -45.13 -24.6 0.26 Allowed 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.215 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.662 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 77.4 mt-30 -53.82 -41.47 67.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.337 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.517 ' O ' ' OE1' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -81.06 -44.78 17.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.148 0.499 . . . . 0.0 110.564 -179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.887 ' CD1' HD12 ' A' ' 40' ' ' LEU . 12.4 t80 -48.79 -60.68 2.54 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.84 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 37' ' ' GLN . 80.1 mt -58.58 -40.71 83.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -54.18 -40.62 67.69 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.646 ' O ' ' N ' ' A' ' 26' ' ' GLU . 2.8 mm100 -60.05 -52.96 63.15 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.623 HD21 ' HB1' ' A' ' 50' ' ' ALA . 10.4 mt -44.31 -22.4 0.07 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.208 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.444 ' N ' ' C ' ' A' ' 23' ' ' GLN . 19.3 ttm-85 -86.95 -27.2 23.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.257 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.646 ' N ' ' O ' ' A' ' 23' ' ' GLN . 26.4 mt-10 -88.49 -55.75 3.59 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.414 1.265 . . . . 0.0 114.414 -177.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.52 -60.02 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.615 -176.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.576 HG21 HD22 ' A' ' 54' ' ' LEU . 0.4 OUTLIER -84.82 -4.52 59.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.693 -178.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.27 32.49 67.9 Favored Glycine 0 CA--C 1.525 0.672 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.834 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.872 HD12 HD23 ' A' ' 54' ' ' LEU . 3.5 mt -98.96 145.47 10.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.77 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' A' ' 33' ' ' THR . 15.0 m-20 -97.33 -44.46 6.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.51 179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -41.82 88.45 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.554 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.575 ' N ' ' O ' ' A' ' 31' ' ' ASN . 19.1 p -60.92 -23.88 65.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -59.45 -44.75 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.05 0.453 . . . . 0.0 110.237 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 24.4 mt -73.87 -31.2 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.498 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.681 ' CD2' HD21 ' A' ' 54' ' ' LEU . 5.7 mt -70.59 -63.57 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.808 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.532 ' OE1' ' N ' ' A' ' 38' ' ' GLN . 0.0 OUTLIER -47.39 -35.48 8.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.103 0.478 . . . . 0.0 110.369 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.532 ' N ' ' OE1' ' A' ' 37' ' ' GLN . 3.5 tp60 -73.34 -34.15 65.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.959 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.64 -44.56 95.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.683 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.887 HD12 ' CD1' ' A' ' 20' ' ' PHE . 3.2 tt -62.89 -44.46 96.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.952 0.406 . . . . 0.0 110.579 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.69 -33.55 66.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.485 ' HB3' ' CZ ' ' A' ' 53' ' ' PHE . 1.9 m-20 -87.18 -23.35 24.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.888 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.535 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 0.3 OUTLIER -88.96 -7.91 55.13 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.026 -179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.421 ' N ' HD22 ' A' ' 44' ' ' ASN . 3.0 m120 66.27 21.84 10.97 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.991 -0.549 . . . . 0.0 112.313 178.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.47 14.54 27.56 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.731 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.639 ' CB ' HD23 ' A' ' 49' ' ' LEU . 4.8 m120 -107.95 127.39 53.71 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.505 HD22 ' CZ ' ' A' ' 20' ' ' PHE . 0.1 OUTLIER -68.78 -62.81 1.23 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -177.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.517 ' C ' HD22 ' A' ' 49' ' ' LEU . 50.5 mt-10 -44.54 -21.69 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.012 0.434 . . . . 0.0 110.702 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.948 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.4 mm? -90.22 -39.44 12.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.684 179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.623 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -64.45 -50.89 65.74 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.697 HG13 ' N ' ' A' ' 52' ' ' ALA . 7.6 p -59.63 -49.43 83.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.368 178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.837 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -61.53 -33.94 74.69 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.528 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.4 OUTLIER -59.11 -28.35 66.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.287 179.312 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.872 HD23 HD12 ' A' ' 30' ' ' ILE . 7.7 mp -80.53 -55.11 5.09 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.436 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.546 ' O ' ' N ' ' A' ' 57' ' ' LYS . 3.1 t -87.76 -44.8 10.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.008 0.433 . . . . 0.0 110.126 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.837 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 26.68 -90.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.8 179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.546 ' N ' ' O ' ' A' ' 55' ' ' THR . 10.1 tptp 69.41 -61.47 0.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.308 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.419 ' N ' ' O ' ' A' ' 56' ' ' ALA . 70.0 m-80 -126.54 -22.08 4.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.063 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -90.27 83.39 5.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.655 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.64 ' O ' ' CB ' ' A' ' 61' ' ' THR . 15.8 tttt -81.43 -99.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.196 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.64 ' CB ' ' O ' ' A' ' 60' ' ' LYS . 1.3 m 93.65 76.52 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.251 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.519 ' C ' ' H ' ' A' ' 64' ' ' GLN . 53.7 Cg_endo -91.07 -126.7 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 123.375 2.716 . . . . 0.0 111.835 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.439 ' H ' ' HB2' ' A' ' 62' ' ' PRO . 1.6 tt0 70.1 -16.4 0.3 Allowed 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.797 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 62' ' ' PRO . 1.8 tp60 -139.99 59.61 1.57 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.792 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.624 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -99.29 122.48 42.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.267 179.797 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.79 -176.13 0.11 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.489 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 69' ' ' TYR . 3.3 m -108.6 144.7 35.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.68 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.31 -53.7 6.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.444 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.43 ' H ' HG22 ' A' ' 67' ' ' THR . 58.9 t80 62.35 143.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.68 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -63.67 -159.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.281 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.9 tp60 -109.15 -26.43 10.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.577 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.732 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 2.3 p -51.14 163.34 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.732 ' HB2' ' O ' ' A' ' 72' ' ' THR . . . 156.65 23.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.305 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.537 ' C ' ' O ' ' A' ' 73' ' ' ALA . 2.9 tp -27.24 93.93 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.612 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.499 ' N ' ' O ' ' A' ' 73' ' ' ALA . 50.4 Cg_exo -49.24 -18.75 2.25 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.686 2.257 . . . . 0.0 112.161 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 79.17 -153.38 37.56 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.525 ' OD1' ' C ' ' A' ' 77' ' ' ASN . 19.5 t-20 -173.6 -67.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.87 0.367 . . . . 0.0 110.596 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -77.22 -174.7 3.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.659 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.54 ' C ' ' H ' ' A' ' 81' ' ' ILE . 6.2 mmm180 -84.89 -24.67 28.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.338 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER 70.27 -35.08 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.516 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.61 ' C ' ' H ' ' A' ' 83' ' ' VAL . 0.4 OUTLIER -128.77 143.21 41.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.349 179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.465 ' O ' ' C ' ' A' ' 83' ' ' VAL . 1.4 m -67.03 19.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.61 ' H ' ' C ' ' A' ' 81' ' ' ILE . 11.8 m 32.73 38.53 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.814 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 82' ' ' SER . . . 68.81 87.34 0.09 OUTLIER Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.13 23.9 7.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.238 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.528 ' O ' ' HB3' ' A' ' 87' ' ' ALA . 1.2 tp60 -57.57 -27.42 62.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.875 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 86' ' ' GLN . . . 70.31 170.4 0.31 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -118.73 -54.35 2.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.681 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.432 HG22 ' H ' ' A' ' 89' ' ' THR . 0.2 OUTLIER -45.84 140.9 3.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.61 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.612 ' O ' ' ND2' ' A' ' 90' ' ' ASN . 0.7 OUTLIER 179.83 29.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.281 0.563 . . . . 0.0 109.742 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 1.3 m -98.23 164.84 2.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.214 -179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.803 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.3 OUTLIER 179.28 -161.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.932 178.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.803 ' N ' HG23 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -145.32 128.81 16.99 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.219 179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.518 ' H ' HD12 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -128.3 12.15 6.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.827 -179.797 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.452 ' O ' ' C ' ' A' ' 96' ' ' GLY . 2.7 t -129.32 -15.65 4.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.452 ' C ' ' O ' ' A' ' 95' ' ' THR . . . -34.68 -67.9 0.25 Allowed Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.597 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.0 OUTLIER -67.3 90.93 0.23 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.821 0.343 . . . . 0.0 110.433 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -53.98 147.32 12.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.711 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -91.62 -6.24 52.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.649 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -87.62 -31.26 19.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.765 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -48.97 -27.42 3.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.624 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.9 OUTLIER -77.19 -52.98 8.31 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.045 0.45 . . . . 0.0 110.669 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.424 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.3 mp0 -44.25 -18.82 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.585 ' N ' ' O ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -85.97 -39.11 17.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.451 -1.249 . . . . 0.0 109.99 179.548 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.624 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -50.33 -57.39 8.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.521 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.514 ' H ' HD12 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -65.31 -54.68 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.6 0 CA-C-O 121.566 0.698 . . . . 0.0 110.332 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.51 -60.23 1.83 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.494 -1.23 . . . . 0.0 110.51 -179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.465 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.4 OUTLIER -47.87 -40.11 20.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.3 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.497 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.1 OUTLIER -68.56 -45.33 72.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.473 -179.978 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mp -48.46 -19.05 0.28 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.497 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.21 2.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.226 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -49.39 -19.61 0.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.016 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.559 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.3 OUTLIER -89.85 -52.35 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 179.614 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -47.56 -10.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.784 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.559 ' H ' ' C ' ' A' ' 113' ' ' SER . 10.2 mpt_? -106.15 -36.61 6.85 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.827 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.576 ' O ' ' O ' ' A' ' 117' ' ' PHE . . . -88.73 -7.44 56.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.122 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.576 ' O ' ' O ' ' A' ' 116' ' ' ALA . 50.6 t80 -43.16 178.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.715 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.552 ' N ' ' CG ' ' A' ' 117' ' ' PHE . 4.8 mtt180 -89.33 82.26 6.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.275 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.516 ' CD ' ' O ' ' A' ' 119' ' ' GLU . 0.5 OUTLIER -70.56 48.13 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.102 -179.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.5 t -53.69 171.49 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.001 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -171.99 -79.64 0.05 OUTLIER Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.216 -0.753 . . . . 0.0 111.216 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -150.89 143.62 16.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.92 0.391 . . . . 0.0 110.83 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.15 26.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.165 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 124' ' ' ASP . 0.6 OUTLIER -118.04 45.26 2.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.729 -179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.5 mp0 -79.06 -35.22 42.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.79 -53.53 45.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.9 0.381 . . . . 0.0 110.453 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 128' ' ' ALA . 0.0 OUTLIER -64.51 -35.98 82.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.161 179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -59.22 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.175 179.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.478 HD13 ' HA ' ' A' ' 129' ' ' ILE . 9.1 mm -35.76 -40.79 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.318 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 30.8 t -66.49 -69.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.497 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -42.15 -48.68 4.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.653 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 128' ' ' ALA . 13.7 t -57.22 -62.39 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.673 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.428 ' HA ' HD13 ' A' ' 133' ' ' LEU . 0.2 OUTLIER -41.38 -35.13 0.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.461 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -61.97 -49.05 77.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.535 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.07 -17.4 25.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.738 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.6 m -87.39 -50.41 6.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.499 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 8.6 tt -76.0 -13.24 14.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.488 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -96.25 4.15 52.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.697 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -96.3 103.1 14.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.449 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -144.84 63.86 1.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.87 -179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.56 117.02 18.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.23 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -112.58 -153.73 0.53 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.896 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.449 ' O ' ' SG ' ' A' ' 143' ' ' CYS . 47.2 t -157.83 32.82 0.26 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.384 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.965 HD23 ' O ' ' A' ' 144' ' ' LEU . 0.0 OUTLIER -60.73 155.67 18.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.557 -179.814 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER -150.6 13.11 0.73 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.285 179.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.634 HH11 ' CG ' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.582 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ttt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.563 ' O ' ' N ' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -110.34 89.75 3.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.395 179.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 3' ' ' VAL . 9.4 p 35.63 28.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.838 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 2' ' ' THR . 2.9 mt-10 -119.18 -165.35 1.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.38 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.474 ' O ' HG23 ' A' ' 7' ' ' VAL . 0.0 OUTLIER 37.77 31.48 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.56 179.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.557 ' C ' ' H ' ' A' ' 8' ' ' LEU . 6.2 m-20 61.81 -88.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.456 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 5' ' ' GLN . 6.5 t 52.09 6.01 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.449 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.661 ' CD2' ' H ' ' A' ' 8' ' ' LEU . 0.9 OUTLIER -87.85 -0.57 57.13 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.656 179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.454 ' N ' HD23 ' A' ' 8' ' ' LEU . 19.0 tt0 -83.37 50.46 1.77 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.71 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.524 ' OE1' ' HB3' ' A' ' 13' ' ' ALA . 19.6 pt20 -121.98 166.03 15.09 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.328 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.45 -44.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.579 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.12 -16.46 61.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.6 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.524 ' HB3' ' OE1' ' A' ' 10' ' ' GLN . . . -70.57 -21.41 62.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.623 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.84 69.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.733 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt -70.21 -19.15 63.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.609 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -82.11 -19.51 39.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.947 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 0.9 OUTLIER -45.7 -40.16 8.94 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.913 0.387 . . . . 0.0 110.18 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.402 HE21 ' HB3' ' A' ' 18' ' ' GLN . 8.9 mm100 -43.74 -58.33 2.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.09 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.48 -34.43 67.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.451 0.643 . . . . 0.0 110.648 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.603 ' CE2' HD13 ' A' ' 40' ' ' LEU . 1.1 t80 -50.72 -60.61 2.87 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.273 -179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 17' ' ' GLN . 2.0 mt -66.24 -47.19 74.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.117 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -48.71 -42.75 36.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.144 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.581 ' O ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -63.16 -53.64 50.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.001 179.687 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.645 ' HA ' HD11 ' A' ' 27' ' ' ILE . 26.4 mt -47.91 -26.1 1.58 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.4 ttm105 -85.38 -19.14 31.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.447 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.571 ' N ' ' O ' ' A' ' 23' ' ' GLN . 7.0 tt0 -86.6 -58.53 2.58 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.859 HD13 ' H ' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -67.24 -54.8 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.563 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 -177.548 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.609 ' N ' HG12 ' A' ' 27' ' ' ILE . 3.3 t -87.75 -2.57 58.7 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.588 -176.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 60.83 4.66 4.48 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-N 115.622 -0.717 . . . . 0.0 113.67 177.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.573 HG22 ' H ' ' A' ' 32' ' ' ASP . 40.8 mm -65.99 125.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 118.077 0.939 . . . . 0.0 109.961 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.552 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -105.57 30.78 5.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.234 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.573 ' H ' HG22 ' A' ' 30' ' ' ILE . 14.9 m-20 -100.7 88.85 3.71 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.4 m -53.84 -30.41 45.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.895 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -67.7 -51.89 44.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.498 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.81 -22.25 17.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.836 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.566 HD12 HD21 ' A' ' 54' ' ' LEU . 0.7 OUTLIER -73.71 -63.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.584 -179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -51.8 -27.53 12.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -73.82 -25.27 60.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.456 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.481 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -73.97 -35.37 64.49 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.006 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.603 HD13 ' CE2' ' A' ' 20' ' ' PHE . 14.1 tp -67.36 -47.75 69.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.399 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -59.78 -41.78 91.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.359 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.471 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 0.9 OUTLIER -86.34 -15.65 39.85 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.116 -179.391 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.661 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -76.8 -31.21 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.483 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.662 ' OD1' ' ND2' ' A' ' 46' ' ' ASN . 0.5 OUTLIER 84.51 13.51 0.27 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.931 -179.529 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.21 13.37 31.26 Favored Glycine 0 CA--C 1.53 1.005 0 C-N-CA 121.112 -0.565 . . . . 0.0 112.388 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.781 ' HB2' HD22 ' A' ' 49' ' ' LEU . 51.0 m-20 -107.92 130.67 55.01 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.616 ' O ' ' N ' ' A' ' 50' ' ' ALA . 53.7 tp -86.02 -64.76 1.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -177.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -46.44 -26.33 0.83 Allowed 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.678 0.751 . . . . 0.0 109.276 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -87.19 -29.85 21.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.478 -1.237 . . . . 0.0 109.387 179.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.838 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -74.26 -58.37 3.34 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.559 HG13 ' N ' ' A' ' 52' ' ' ALA . 14.5 p -43.63 -40.07 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 177.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.796 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -67.64 -27.89 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 114.252 -1.34 . . . . 0.0 110.392 179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.696 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -60.0 -28.92 68.1 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.452 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.803 ' N ' HD12 ' A' ' 54' ' ' LEU . 5.6 mp -80.62 -53.51 6.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.299 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.61 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -86.8 -47.79 8.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.025 179.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.796 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 30.58 104.77 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.092 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.664 ' O ' ' N ' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -69.36 -174.1 0.63 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.172 -179.71 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.872 HD21 ' H ' ' A' ' 63' ' ' GLN . 4.6 t30 38.81 16.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.075 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.664 ' N ' ' O ' ' A' ' 57' ' ' LYS . . . 60.77 -73.45 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.333 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.577 ' N ' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -117.21 -72.47 0.69 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.144 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.576 ' N ' HD22 ' A' ' 58' ' ' ASN . 0.0 OUTLIER -175.7 -47.07 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.262 0 C-N-CA 120.801 -0.359 . . . . 0.0 111.11 179.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.561 ' CD ' ' N ' ' A' ' 61' ' ' THR . 50.0 Cg_endo -87.93 32.67 0.41 Allowed 'Trans proline' 0 C--N 1.304 -1.805 0 C-N-CA 123.186 2.591 . . . . 0.0 112.205 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.872 ' H ' HD21 ' A' ' 58' ' ' ASN . 3.9 tt0 -102.03 -156.28 0.55 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.279 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.444 ' O ' ' C ' ' A' ' 65' ' ' GLU . 3.8 mp0 -67.08 60.02 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.444 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.558 ' O ' ' OD1' ' A' ' 58' ' ' ASN . 4.7 mt-10 36.95 -130.3 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.544 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -132.68 23.25 4.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.466 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 68' ' ' THR . 4.4 m 70.97 -128.41 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.645 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.469 ' H ' HG22 ' A' ' 67' ' ' THR . 27.8 p -141.16 -52.95 0.46 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.709 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.455 ' CD2' ' O ' ' A' ' 68' ' ' THR . 15.8 m-85 -163.75 160.86 23.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.704 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.664 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -116.61 -165.03 1.02 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -122.63 104.04 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.555 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 79.8 p -123.67 -26.07 4.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.53 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.475 ' O ' ' C ' ' A' ' 74' ' ' LEU . . . -91.26 -151.46 0.26 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.537 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' A' ' 73' ' ' ALA . 3.2 tp 34.03 91.95 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.568 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -81.47 -3.84 12.12 Favored 'Trans proline' 0 C--N 1.306 -1.658 0 C-N-CA 122.795 2.33 . . . . 0.0 111.985 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 104.6 -0.24 42.79 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.514 ' O ' ' ND2' ' A' ' 77' ' ' ASN . 0.8 OUTLIER 47.8 53.1 11.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.799 0.333 . . . . 0.0 110.57 179.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -55.77 169.27 0.36 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.462 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.476 ' CG ' ' N ' ' A' ' 80' ' ' TYR . 45.0 ttp180 -155.01 160.35 41.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.335 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.591 ' O ' ' C ' ' A' ' 81' ' ' ILE . 0.2 OUTLIER -116.04 -171.86 2.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.429 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.591 ' C ' ' O ' ' A' ' 80' ' ' TYR . 0.2 OUTLIER 16.04 76.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.198 179.929 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.7 p -98.42 -31.87 11.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.549 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 15.4 t -83.04 66.0 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.684 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.506 ' O ' ' C ' ' A' ' 85' ' ' SER . . . -60.32 -44.94 97.0 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.756 -0.937 . . . . 0.0 110.756 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.506 ' C ' ' O ' ' A' ' 84' ' ' GLY . 4.8 p 30.66 50.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.786 0.327 . . . . 0.0 110.674 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -76.12 -171.09 1.59 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.466 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -125.39 131.56 52.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.553 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -131.82 33.83 3.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.559 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.2 t -135.63 125.53 25.75 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.409 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.534 ' O ' ' CG ' ' A' ' 90' ' ' ASN . 15.7 t30 -169.67 25.32 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.298 0.571 . . . . 0.0 109.691 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -101.48 153.88 4.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.037 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.804 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.8 OUTLIER -179.8 -159.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.634 178.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.804 ' N ' HG23 ' A' ' 92' ' ' ILE . 1.2 p30 -116.34 136.31 53.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.501 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 mt -94.62 -5.96 44.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.64 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.481 HG23 ' H ' ' A' ' 96' ' ' GLY . 0.1 OUTLIER -116.37 -57.48 2.19 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.679 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.481 ' H ' HG23 ' A' ' 95' ' ' THR . . . 102.69 11.61 34.78 Favored Glycine 0 CA--C 1.526 0.73 0 N-CA-C 110.846 -0.902 . . . . 0.0 110.846 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -179.56 145.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.841 0.353 . . . . 0.0 110.425 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -69.13 154.81 41.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.466 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' C ' ' N ' ' A' ' 101' ' ' ASP . 7.2 mmmt -86.29 -5.93 59.07 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.613 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.502 ' OD1' ' N ' ' A' ' 101' ' ' ASP . 60.1 p30 -49.33 -17.64 0.28 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.502 ' N ' ' OD1' ' A' ' 100' ' ' ASP . 12.3 m-20 -55.31 -23.5 23.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.605 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.866 HD12 ' N ' ' A' ' 103' ' ' GLN . 4.2 pp -56.03 -46.11 78.93 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.086 0.469 . . . . 0.0 110.16 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.866 ' N ' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -46.14 -19.71 0.08 Allowed 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 178.528 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.534 ' N ' ' C ' ' A' ' 102' ' ' LEU . 20.8 ttp85 -85.09 -37.04 20.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.968 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.565 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -62.95 -45.3 93.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.314 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.819 HD13 ' N ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -69.44 -32.66 53.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-O 121.236 0.541 . . . . 0.0 110.537 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.36 -60.29 3.58 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.237 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 30.7 mt -47.24 -42.58 20.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.521 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.454 ' C ' ' N ' ' A' ' 111' ' ' ALA . 81.2 p -72.69 -41.77 64.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.661 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 mt -48.2 -19.94 0.33 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.454 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -89.44 -58.59 2.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.24 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -48.21 -21.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.563 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.659 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.2 OUTLIER -89.65 -46.85 8.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.879 179.289 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.661 ' O ' ' ND2' ' A' ' 114' ' ' ASN . 0.2 OUTLIER -39.01 -20.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.218 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.659 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -107.21 -40.39 5.42 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.199 179.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.438 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -95.61 23.09 6.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.504 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.536 ' N ' ' O ' ' A' ' 113' ' ' SER . 12.8 t80 -83.34 -78.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.659 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -49.66 -37.13 27.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.587 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 59.88 42.91 15.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.52 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.409 ' H ' HG22 ' A' ' 120' ' ' THR . 2.2 t -88.18 172.72 9.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.622 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 83.52 16.67 68.04 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 8.3 tp -59.3 148.13 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.75 0.31 . . . . 0.0 110.496 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 65.6 p -126.26 106.62 9.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.457 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -84.11 125.02 31.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.484 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 128' ' ' ALA . 0.3 OUTLIER -48.7 -54.69 13.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.869 -179.876 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -51.24 -48.74 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.854 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -61.7 -25.89 67.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.774 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -66.45 -68.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.75 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.653 ' H ' HD12 ' A' ' 129' ' ' ILE . 2.6 mp -49.35 -33.07 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.845 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' CB ' ' A' ' 134' ' ' GLU . 0.0 OUTLIER -68.73 -25.3 64.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.747 -179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 131' ' ' ARG . 4.5 mmm180 -85.26 -49.59 8.06 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' A' ' 133' ' ' LEU . 0.8 OUTLIER -54.98 -40.99 56.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.773 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.503 ' N ' ' CG1' ' A' ' 132' ' ' VAL . 4.1 tp -80.55 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.544 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.478 ' CB ' ' O ' ' A' ' 130' ' ' SER . 1.4 tt0 -38.0 -31.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.362 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.447 ' N ' ' O ' ' A' ' 133' ' ' LEU . . . -78.62 -52.5 8.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.57 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -40.78 25.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.781 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -98.26 -62.22 2.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.597 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . 59.82 162.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.47 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -119.81 64.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.627 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.414 ' OD1' ' N ' ' A' ' 140' ' ' ASN . 1.6 m120 -92.25 -10.67 37.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.429 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.584 ' NZ ' ' SG ' ' A' ' 143' ' ' CYS . 19.9 tttm -94.47 126.29 39.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.726 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -123.76 104.67 9.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.485 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.584 ' SG ' ' NZ ' ' A' ' 141' ' ' LYS . 58.2 m -62.67 151.29 38.65 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.648 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.476 HD22 ' N ' ' A' ' 144' ' ' LEU . 4.5 mm? -84.96 91.99 8.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.566 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.0 tttp -40.3 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.505 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 146' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.416 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.563 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mtt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.579 ' O ' ' N ' ' A' ' 4' ' ' GLU . 4.2 m -92.61 -73.3 0.56 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.436 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.6 ' O ' HG22 ' A' ' 3' ' ' VAL . 3.4 p -57.1 75.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.734 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.579 ' N ' ' O ' ' A' ' 2' ' ' THR . 1.6 mt-10 -129.2 148.55 51.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.74 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.545 ' O ' ' C ' ' A' ' 6' ' ' ASN . 2.5 tt0 -151.83 -55.44 0.14 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.355 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.545 ' C ' ' O ' ' A' ' 5' ' ' GLN . 14.2 p-10 26.96 56.04 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.801 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -43.94 135.02 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.298 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 57.7 tp -161.34 135.28 6.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.669 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -93.6 108.94 20.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.109 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.584 ' O ' ' CB ' ' A' ' 11' ' ' SER . 0.0 OUTLIER -124.81 -171.83 2.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.765 -179.667 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.584 ' CB ' ' O ' ' A' ' 10' ' ' GLN . 1.8 t 88.62 -147.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.725 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.5 -15.6 63.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.57 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.39 -20.88 66.57 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.766 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -50.72 -19.27 0.9 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.919 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.07 -18.78 33.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.371 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -50.63 -33.34 21.9 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.295 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.832 ' NE2' ' H ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -45.65 -29.67 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.728 -179.646 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.65 ' N ' ' OE1' ' A' ' 18' ' ' GLN . 3.8 mp0 -61.52 -58.28 8.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.663 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.644 ' O ' ' NE2' ' A' ' 23' ' ' GLN . 0.4 OUTLIER -73.78 -34.92 64.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.446 0.641 . . . . 0.0 110.213 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.456 ' CE1' HD23 ' A' ' 40' ' ' LEU . 2.1 t80 -51.89 -60.77 2.79 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.91 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.9 mt -67.72 -31.99 72.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.983 -179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.481 ' HB3' HE22 ' A' ' 23' ' ' GLN . 1.6 t30 -60.11 -41.87 93.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.924 0.392 . . . . 0.0 110.147 179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.752 ' N ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -67.32 -50.18 61.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.109 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.833 ' HB3' HD22 ' A' ' 36' ' ' LEU . 12.6 mt -45.57 -31.82 2.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.33 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.1 ttt-85 -87.61 -20.62 26.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.908 0.385 . . . . 0.0 110.492 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.541 ' OE2' ' O ' ' A' ' 65' ' ' GLU . 2.1 tt0 -87.58 -58.08 2.71 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.553 HD13 ' H ' ' A' ' 28' ' ' THR . 0.2 OUTLIER -62.76 -44.59 99.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.196 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.553 ' H ' HD13 ' A' ' 27' ' ' ILE . 1.4 t -99.64 -2.68 34.89 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.364 -0.934 . . . . 0.0 111.676 -178.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 63.65 19.33 62.62 Favored Glycine 0 CA--C 1.526 0.752 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.453 178.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.525 ' HB ' HD21 ' A' ' 36' ' ' LEU . 7.1 mm -79.12 113.56 18.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.541 ' CG ' ' N ' ' A' ' 32' ' ' ASP . 0.8 OUTLIER -76.75 -50.77 12.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.788 -179.616 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.541 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.7 m-20 -41.43 103.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.308 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.6 t -71.76 -27.22 62.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.737 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -59.64 -41.71 91.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.518 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.403 HG22 ' CD1' ' A' ' 54' ' ' LEU . 12.8 mm -68.38 -45.84 81.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.705 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.833 HD22 ' HB3' ' A' ' 24' ' ' LEU . 18.2 mt -63.98 -60.75 2.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.189 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.422 ' C ' ' O ' ' A' ' 36' ' ' LEU . 4.9 mm-40 -43.46 -29.2 0.43 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.421 ' N ' ' C ' ' A' ' 36' ' ' LEU . 3.1 tt0 -78.87 -32.28 45.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.083 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.631 ' N ' ' O ' ' A' ' 36' ' ' LEU . . . -69.64 -33.79 73.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.796 ' C ' HD13 ' A' ' 40' ' ' LEU . 3.0 tm? -66.12 -38.28 87.79 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.093 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.4 mmtm -71.13 -42.61 68.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.97 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.56 -24.13 25.57 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.861 0.363 . . . . 0.0 111.481 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.593 ' OG ' ' O ' ' A' ' 39' ' ' ALA . 6.9 p -62.82 -30.3 71.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.778 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.524 ' CB ' ' O ' ' A' ' 43' ' ' SER . 1.2 t-20 83.66 14.28 0.33 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.01 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.84 4.97 48.24 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.06 -0.59 . . . . 0.0 111.642 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.62 ' CB ' HD22 ' A' ' 49' ' ' LEU . 2.9 m120 -100.74 130.16 46.74 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.655 ' O ' ' N ' ' A' ' 50' ' ' ALA . 2.1 tt -85.75 -62.84 1.43 Allowed 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.879 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.522 ' O ' HG13 ' A' ' 51' ' ' VAL . 3.5 mt-10 -41.4 -38.21 1.19 Allowed 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.093 0.473 . . . . 0.0 110.393 -179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.959 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -81.13 -26.56 36.04 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.235 179.727 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.959 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -69.63 -58.46 3.91 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.56 HG13 ' N ' ' A' ' 52' ' ' ALA . 1.6 p -44.41 -44.96 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.74 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 177.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.746 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -61.73 -28.62 69.55 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 113.282 -1.781 . . . . 0.0 110.361 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.641 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -64.32 -29.51 70.59 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.509 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 54' ' ' LEU . 3.1 mm? -75.66 -57.59 3.79 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.287 -179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.609 ' O ' ' CD ' ' A' ' 57' ' ' LYS . 3.1 t -89.84 -44.86 9.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.683 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.746 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 42.9 47.52 4.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.564 178.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.609 ' CD ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -169.92 -56.71 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.349 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 59' ' ' ALA . 15.7 t-20 -178.9 120.72 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.634 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 176.53 121.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.452 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.531 ' HG2' ' N ' ' A' ' 61' ' ' THR . 0.0 OUTLIER -141.0 -171.3 3.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.972 -179.375 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.708 HG22 ' O ' ' A' ' 61' ' ' THR . 1.3 m 169.71 91.86 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.199 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.166 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.563 ' O ' ' N ' ' A' ' 64' ' ' GLN . 93.4 Cg_endo -90.63 -16.14 1.64 Allowed 'Trans proline' 0 C--N 1.306 -1.69 0 C-N-CA 123.156 2.571 . . . . 0.0 112.119 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.59 ' O ' ' C ' ' A' ' 64' ' ' GLN . 7.0 tt0 -29.91 92.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.269 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.59 ' C ' ' O ' ' A' ' 63' ' ' GLN . 5.1 mm-40 -15.18 89.41 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.464 -179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.541 ' O ' ' OE2' ' A' ' 26' ' ' GLU . 18.8 tt0 -130.76 120.8 24.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.564 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -163.24 -64.93 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.397 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.4 t -177.49 -16.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.723 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.662 HG22 ' H ' ' A' ' 69' ' ' TYR . 7.5 m 66.8 -131.26 0.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.656 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.662 ' H ' HG22 ' A' ' 68' ' ' THR . 58.5 m-85 57.3 170.97 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.672 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -78.98 -150.74 0.05 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.593 ' C ' ' H ' ' A' ' 73' ' ' ALA . 2.0 tm0? -109.79 -63.0 1.42 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.484 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.521 ' O ' HG22 ' A' ' 72' ' ' THR . 88.9 m 60.12 -7.53 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.08 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.593 ' H ' ' C ' ' A' ' 71' ' ' GLN . . . 36.26 -157.63 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.546 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.3 tp -52.86 112.65 3.7 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.669 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -46.96 -28.06 6.66 Favored 'Trans proline' 0 C--N 1.311 -1.413 0 C-N-CA 122.295 1.997 . . . . 0.0 112.036 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.542 ' O ' ' C ' ' A' ' 77' ' ' ASN . . . 61.81 -170.33 10.79 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.542 ' C ' ' O ' ' A' ' 76' ' ' GLY . 7.6 p30 28.7 67.92 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.764 0.316 . . . . 0.0 110.512 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.471 ' CG ' ' O ' ' A' ' 78' ' ' ASP . 7.2 p-10 -160.92 103.5 1.31 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.882 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.465 ' HE ' ' HB ' ' A' ' 83' ' ' VAL . 19.5 ttp180 -124.54 15.09 8.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.232 179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 64.66 -51.82 0.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.524 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.661 HG22 ' H ' ' A' ' 82' ' ' SER . 10.4 mt -105.09 171.89 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.907 0.384 . . . . 0.0 111.044 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.661 ' H ' HG22 ' A' ' 81' ' ' ILE . 2.5 m -41.83 138.43 1.48 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.627 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.575 ' O ' HG22 ' A' ' 83' ' ' VAL . 8.4 p -158.38 63.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.575 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.01 -50.45 0.01 OUTLIER Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 59.95 76.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.696 0.284 . . . . 0.0 110.647 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -79.81 -92.14 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.57 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -170.43 -175.27 1.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.465 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.457 ' O ' ' O ' ' A' ' 89' ' ' THR . 3.6 t0 -150.2 -36.59 0.15 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.457 ' O ' ' O ' ' A' ' 88' ' ' ASP . 23.9 m 57.56 116.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.196 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -174.08 32.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.13 0.49 . . . . 0.0 109.828 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.5 161.18 3.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.134 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.814 HG23 ' N ' ' A' ' 93' ' ' ASP . 1.9 tt -179.79 -160.58 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.816 179.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.814 ' N ' HG23 ' A' ' 92' ' ' ILE . 68.9 m-20 -54.47 -43.43 71.72 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.687 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.62 ' H ' HG23 ' A' ' 92' ' ' ILE . 0.6 OUTLIER 81.79 -53.81 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.858 0.361 . . . . 0.0 110.383 -179.858 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.495 ' O ' ' C ' ' A' ' 96' ' ' GLY . 3.1 t -74.75 -36.04 62.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.215 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.495 ' C ' ' O ' ' A' ' 95' ' ' THR . . . 31.08 47.28 0.17 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -87.96 150.51 23.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.69 0.281 . . . . 0.0 110.381 179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -106.06 86.18 2.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -79.65 -47.51 15.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.178 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.7 -37.12 39.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.973 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -80.33 -21.87 42.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.262 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.642 ' O ' ' N ' ' A' ' 105' ' ' ALA . 0.8 OUTLIER -64.86 -52.92 54.02 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.064 0.459 . . . . 0.0 110.325 179.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.406 ' C ' ' O ' ' A' ' 102' ' ' LEU . 3.9 mm-40 -44.67 -18.33 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.583 ' N ' ' C ' ' A' ' 102' ' ' LEU . 13.5 tpp180 -84.54 -35.5 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.687 -1.142 . . . . 0.0 109.873 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.642 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -60.91 -40.71 94.19 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.481 HD13 ' N ' ' A' ' 106' ' ' ILE . 1.3 mm -67.75 -40.32 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.611 0.72 . . . . 0.0 109.772 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.91 75.28 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.214 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.8 OUTLIER -58.84 -41.05 86.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.133 179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.458 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.3 m -72.91 -47.89 41.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.225 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.43 -18.58 0.24 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.458 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -84.99 -52.86 5.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.274 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -47.12 -20.96 0.19 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.189 0.519 . . . . 0.0 109.74 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.568 ' C ' ' H ' ' A' ' 115' ' ' ARG . 20.1 m -87.42 -54.03 4.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.039 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -48.35 -11.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.568 ' H ' ' C ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -94.82 -42.23 8.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.055 178.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.48 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -83.68 20.24 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.529 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.49 171.24 19.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.427 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.627 ' C ' ' H ' ' A' ' 120' ' ' THR . 9.8 ptt85 175.1 -50.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.949 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 45.97 6.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.018 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.627 ' H ' ' C ' ' A' ' 118' ' ' ARG . 45.1 p -48.1 -53.0 18.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.404 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 78.95 93.25 0.32 Allowed Glycine 0 CA--C 1.524 0.61 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 6.3 mt -147.93 127.27 4.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.475 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.0 156.25 39.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.447 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -109.38 -38.25 5.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.477 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.568 ' OE2' ' OE1' ' A' ' 126' ' ' GLU . 1.0 OUTLIER -49.95 -32.72 15.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.474 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.568 ' OE1' ' OE2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -60.89 -31.59 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.988 0.423 . . . . 0.0 110.177 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.43 -37.41 65.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.458 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.06 -65.8 0.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 1.2 pt -46.68 -32.84 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.411 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 14.5 t -63.02 -37.98 89.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.638 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 35.8 ttt180 -65.76 -39.38 91.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.425 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 78.8 t -57.73 -57.69 9.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.635 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.0 mp -48.77 -59.45 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.691 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -52.53 -58.48 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -51.23 -32.49 24.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.85 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 5.7 p -92.26 -5.23 52.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.86 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 60.7 mt -113.45 -72.76 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.462 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.598 ' O ' ' O ' ' A' ' 139' ' ' GLU . . . 59.77 98.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.654 ' CG ' ' H ' ' A' ' 140' ' ' ASN . 1.1 tp10 13.44 -134.47 0.0 OUTLIER 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.746 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.654 ' H ' ' CG ' ' A' ' 139' ' ' GLU . 0.5 OUTLIER 160.29 -169.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.633 -179.822 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 140' ' ' ASN . 0.0 OUTLIER 33.59 66.7 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.783 179.741 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.657 ' O ' ' SG ' ' A' ' 143' ' ' CYS . . . -50.31 -23.77 2.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.527 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.657 ' SG ' ' O ' ' A' ' 142' ' ' ALA . 1.3 m 155.89 -172.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.614 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.809 HD23 ' N ' ' A' ' 144' ' ' LEU . 1.8 pt? -165.57 42.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.68 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -109.07 115.08 29.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.565 ' OXT' ' CG ' ' A' ' 146' ' ' ARG . 21.2 ptt180 . . . . . 0 C--O 1.219 -0.536 0 CA-C-O 118.084 -0.96 . . . . 0.0 110.463 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.586 ' C ' ' H ' ' A' ' 4' ' ' GLU . 2.2 t -154.01 79.85 1.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.562 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.549 ' O ' HG22 ' A' ' 3' ' ' VAL . 7.3 p -48.23 -6.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.811 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.586 ' H ' ' C ' ' A' ' 2' ' ' THR . 20.7 tt0 176.3 130.98 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.653 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.435 ' HG2' ' H ' ' A' ' 6' ' ' ASN . 4.4 tt0 -118.6 -157.34 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.373 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.505 ' O ' HG13 ' A' ' 7' ' ' VAL . 3.0 m120 62.98 -127.36 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.22 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.598 ' O ' ' O ' ' A' ' 8' ' ' LEU . 11.1 m -156.06 -46.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 121.063 -0.255 . . . . 0.0 110.496 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.598 ' O ' ' O ' ' A' ' 7' ' ' VAL . 0.2 OUTLIER 23.76 103.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.095 0.474 . . . . 0.0 111.034 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.86 59.8 3.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.699 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.606 ' O ' ' N ' ' A' ' 12' ' ' ALA . 3.3 pt20 -74.95 135.77 41.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.511 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.7 t -60.11 68.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.624 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.606 ' N ' ' O ' ' A' ' 10' ' ' GLN . . . -53.71 -17.65 2.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.636 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.525 ' O ' ' OE1' ' A' ' 17' ' ' GLN . . . -73.42 -30.33 63.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.626 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.461 ' HA ' ' NE2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -57.62 -26.91 62.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.67 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 tmtm? -85.44 -18.62 33.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.667 -179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -22.18 38.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.516 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -50.72 -25.86 4.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.717 -179.73 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -58.61 7.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.794 -179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.423 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -73.75 -41.26 62.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.334 0.588 . . . . 0.0 110.381 -179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.625 ' CE1' HD23 ' A' ' 40' ' ' LEU . 19.4 t80 -50.53 -61.02 2.44 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.142 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.674 HD21 ' HA ' ' A' ' 37' ' ' GLN . 17.8 mt -59.25 -49.93 75.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.145 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -44.74 -41.21 6.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.665 ' O ' ' N ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -65.17 -52.48 54.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.866 179.025 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.747 HD21 ' HB1' ' A' ' 50' ' ' ALA . 11.2 mt -43.66 -28.07 0.37 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.824 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.36 -23.12 24.68 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.131 0.491 . . . . 0.0 109.742 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.665 ' N ' ' O ' ' A' ' 23' ' ' GLN . 0.6 OUTLIER -88.02 -56.69 3.22 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -178.016 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -53.14 -59.53 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-O 121.016 0.436 . . . . 0.0 111.741 -176.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.837 ' OG1' HD13 ' A' ' 30' ' ' ILE . 0.2 OUTLIER -81.35 -13.53 58.24 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.24 -178.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 65.36 31.97 82.12 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.134 -1.187 . . . . 0.0 110.134 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.837 HD13 ' OG1' ' A' ' 28' ' ' THR . 0.4 OUTLIER -90.07 152.76 3.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.913 0.387 . . . . 0.0 110.532 -179.065 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 33' ' ' THR . 0.4 OUTLIER -105.15 -39.38 6.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.746 -179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.439 ' HB3' HD12 ' A' ' 35' ' ' ILE . 7.2 m-20 -48.75 85.89 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.21 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.587 ' N ' ' O ' ' A' ' 31' ' ' ASN . 18.0 p -60.8 -20.21 61.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.012 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -66.99 -49.61 64.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.873 0.368 . . . . 0.0 110.971 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.439 HD12 ' HB3' ' A' ' 32' ' ' ASP . 3.3 mt -63.82 -31.23 52.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.137 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.638 ' CD2' HD21 ' A' ' 54' ' ' LEU . 8.8 mt -63.59 -61.78 2.09 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.758 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.674 ' HA ' HD21 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -48.7 -27.24 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.245 0.545 . . . . 0.0 109.59 179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.491 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 5.1 mt-30 -80.4 -37.95 31.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.372 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.76 97.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.114 179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.901 ' C ' HD13 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -62.54 -42.29 99.43 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.713 ' N ' HD13 ' A' ' 40' ' ' LEU . 1.9 mmtp -52.22 -33.39 41.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.908 179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.506 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.5 OUTLIER -86.74 -43.87 12.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.599 179.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.599 ' HG ' ' HZ ' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -65.63 -29.54 70.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.466 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.558 ' CG ' ' O ' ' A' ' 43' ' ' SER . 4.4 p30 48.65 53.16 12.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.056 179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.38 -9.42 57.49 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.547 178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.562 ' O ' ' OG ' ' A' ' 43' ' ' SER . 4.9 m120 -96.0 116.39 28.88 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.007 0.404 . . . . 0.0 110.198 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.577 ' O ' ' N ' ' A' ' 49' ' ' LEU . 0.2 OUTLIER -77.41 -63.82 1.29 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.476 -178.492 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.502 ' C ' HD22 ' A' ' 49' ' ' LEU . 24.9 tt0 -42.88 -20.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.743 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.6 mm? -87.69 -52.48 5.3 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.713 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.747 ' HB1' HD21 ' A' ' 24' ' ' LEU . . . -51.1 -47.15 62.0 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.949 HG13 ' H ' ' A' ' 52' ' ' ALA . 6.5 p -63.21 -62.66 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 CA-C-O 121.517 0.675 . . . . 0.0 109.219 178.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.949 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -47.36 -27.42 1.62 Allowed 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 114.884 -1.053 . . . . 0.0 109.236 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.506 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.2 OUTLIER -65.74 -38.02 88.0 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.081 178.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.638 HD21 ' CD2' ' A' ' 36' ' ' LEU . 7.8 mp -69.8 -56.65 6.55 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.261 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.594 ' O ' ' O ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -80.85 -50.37 9.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.052 179.638 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.835 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . 27.21 103.06 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.166 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -86.62 105.51 16.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.55 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.473 ' O ' ' C ' ' A' ' 59' ' ' ALA . 2.3 t-20 69.25 -60.18 0.47 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.404 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.473 ' C ' ' O ' ' A' ' 58' ' ' ASN . . . -34.22 139.25 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.611 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.511 ' C ' ' OG1' ' A' ' 61' ' ' THR . 11.9 tttm -162.15 137.31 7.17 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.736 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.511 ' OG1' ' C ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER 173.84 70.64 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.218 0 CA-C-O 121.045 0.45 . . . . 0.0 110.658 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.451 ' HG3' ' HZ1' ' A' ' 60' ' ' LYS . 73.9 Cg_endo -92.17 -98.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 123.406 2.737 . . . . 0.0 112.389 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.68 ' O ' ' N ' ' A' ' 65' ' ' GLU . 19.2 tm0? 72.0 145.85 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.2 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -56.14 69.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.473 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.68 ' N ' ' O ' ' A' ' 63' ' ' GLN . 3.6 tt0 -73.43 133.68 43.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.4 ' O ' ' O ' ' A' ' 65' ' ' GLU . 2.8 mp0 -59.61 -152.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.463 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.609 ' OG1' ' N ' ' A' ' 68' ' ' THR . 0.2 OUTLIER -124.91 -93.12 0.5 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.692 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.609 ' N ' ' OG1' ' A' ' 67' ' ' THR . 25.5 m 65.19 104.58 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.302 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.633 ' N ' ' CD1' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -104.21 -177.73 3.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.751 -179.72 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.469 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -82.1 -169.31 2.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.602 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -102.4 -178.86 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.703 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 73' ' ' ALA . 0.2 OUTLIER -112.86 -165.97 1.04 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.425 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 72' ' ' THR . . . 162.06 137.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.415 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.858 HD23 ' O ' ' A' ' 74' ' ' LEU . 0.7 OUTLIER -65.36 124.84 88.17 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.736 -179.824 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -41.05 -45.89 5.17 Favored 'Trans proline' 0 C--N 1.312 -1.378 0 C-N-CA 122.397 2.065 . . . . 0.0 112.08 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 51.15 93.75 0.01 OUTLIER Glycine 0 CA--C 1.525 0.691 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.53 ' O ' ' C ' ' A' ' 78' ' ' ASP . 73.3 m-20 -141.59 -114.99 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.942 0.401 . . . . 0.0 110.662 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.53 ' C ' ' O ' ' A' ' 77' ' ' ASN . 4.2 p-10 27.76 84.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.897 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.4 mtt180 -86.91 -78.92 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.096 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 62.48 159.89 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.1 0.476 . . . . 0.0 111.045 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.6 mt 70.99 105.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.657 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.07 166.39 24.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.569 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 28.7 m -144.26 150.55 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.48 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -66.95 -74.54 0.54 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 70.59 10.77 7.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.85 0.357 . . . . 0.0 110.344 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -125.91 164.03 21.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.574 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . 54.35 45.39 27.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -88.33 20.6 3.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.71 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.8 m -52.9 145.61 12.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.53 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -161.27 36.6 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.4 ' C ' HG22 ' A' ' 92' ' ' ILE . 0.3 OUTLIER -130.86 171.54 17.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.988 -179.182 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.63 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 2.7 tt 171.4 163.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.904 179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.63 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 2.3 m-20 47.37 -176.85 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.281 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.574 ' C ' HD12 ' A' ' 94' ' ' LEU . 2.9 pp -149.93 -6.86 0.32 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.19 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.615 ' C ' ' H ' ' A' ' 97' ' ' ASP . 10.1 t -87.53 -33.04 19.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.357 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.45 ' O ' ' CB ' ' A' ' 97' ' ' ASP . . . 57.13 -4.3 0.05 OUTLIER Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.615 ' H ' ' C ' ' A' ' 95' ' ' THR . 1.3 p30 165.01 145.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.667 0.27 . . . . 0.0 110.616 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.7 151.12 30.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.652 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.572 ' HZ3' ' CB ' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -88.76 1.97 54.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.592 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.559 ' O ' ' OD1' ' A' ' 100' ' ' ASP . 12.8 t0 -71.84 -15.91 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.583 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -59.22 -57.35 13.42 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.789 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.538 ' O ' ' N ' ' A' ' 105' ' ' ALA . 3.0 pp -69.03 -42.09 76.82 Favored 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.423 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.582 ' HA ' HD11 ' A' ' 106' ' ' ILE . 2.0 tp60 -50.4 -19.38 0.83 Allowed 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.507 ' N ' ' C ' ' A' ' 102' ' ' LEU . 1.1 ttm180 -86.27 -32.65 20.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.398 -1.273 . . . . 0.0 110.003 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -56.47 -56.84 16.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.427 -179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.678 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.6 OUTLIER -77.53 -33.61 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.318 -179.217 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.59 -59.87 4.32 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.283 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.872 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.8 tp -53.83 -35.68 61.72 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.15 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.514 ' C ' ' N ' ' A' ' 111' ' ' ALA . 1.6 t -64.27 -52.62 57.71 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 tp -48.12 -18.58 0.21 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.872 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -72.67 -53.92 10.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.817 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' A' ' 112' ' ' GLU . 6.3 mm-40 -46.51 -23.08 0.33 Allowed 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.486 ' C ' ' H ' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -86.15 -44.19 12.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.88 179.303 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.466 ' ND2' ' HD2' ' A' ' 115' ' ' ARG . 0.0 OUTLIER -53.62 -9.7 0.22 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 179.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.486 ' H ' ' C ' ' A' ' 113' ' ' SER . 2.1 mpt_? -101.61 -46.31 5.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.823 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.59 -7.48 20.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.862 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -91.03 -154.58 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.252 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.63 ' O ' ' N ' ' A' ' 120' ' ' THR . 37.8 mtt180 57.38 29.85 17.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.44 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -56.2 72.84 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.63 ' N ' ' O ' ' A' ' 118' ' ' ARG . 3.8 t -56.48 107.42 0.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.277 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -100.71 134.43 11.69 Favored Glycine 0 CA--C 1.524 0.637 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.588 ' O ' ' CB ' ' A' ' 123' ' ' THR . 0.5 OUTLIER -60.65 -26.53 38.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.785 0.326 . . . . 0.0 110.563 179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.615 HG22 ' H ' ' A' ' 124' ' ' ASP . 1.6 m 89.59 -142.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.56 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.615 ' H ' HG22 ' A' ' 123' ' ' THR . 0.0 OUTLIER 50.79 11.25 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.443 -179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.472 ' H ' ' C ' ' A' ' 123' ' ' THR . 2.8 tp10 -58.74 -40.45 83.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.627 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.7 mp0 -59.02 -37.98 78.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.601 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -73.36 -38.16 65.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.511 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.35 -54.62 43.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.688 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.427 HG13 ' N ' ' A' ' 130' ' ' SER . 31.7 pt -59.39 -36.32 63.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.597 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.478 ' O ' ' C ' ' A' ' 131' ' ' ARG . 3.6 m -63.38 -74.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.502 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.478 ' C ' ' O ' ' A' ' 130' ' ' SER . 2.3 tpp180 -33.8 -65.94 0.17 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.387 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.456 ' O ' ' C ' ' A' ' 133' ' ' LEU . 79.5 t -39.48 -61.28 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.526 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.456 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER -35.53 -51.74 0.64 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.514 179.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.567 ' C ' ' H ' ' A' ' 136' ' ' SER . 48.6 mt-10 -63.55 -64.68 0.83 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.579 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.59 9.49 0.06 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.721 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.567 ' H ' ' C ' ' A' ' 134' ' ' GLU . 13.5 t -126.17 -11.25 6.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.635 179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.558 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.2 tt -108.37 -12.16 10.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.421 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.503 ' O ' ' C ' ' A' ' 139' ' ' GLU . . . -45.04 -13.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.612 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 137' ' ' ILE . 4.1 tt0 -31.54 -57.7 0.27 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.604 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -116.4 132.55 56.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.722 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -178.2 146.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.369 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -125.75 122.18 35.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.767 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.54 94.7 3.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.346 179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.78 144.78 37.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -167.24 86.68 0.27 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.477 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.633 -179.972 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.43 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.503 ' O ' ' C ' ' A' ' 3' ' ' VAL . 55.1 m -85.28 -78.71 0.25 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.731 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.503 ' C ' ' O ' ' A' ' 2' ' ' THR . 1.3 m -29.84 133.54 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.933 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.5 ' O ' ' C ' ' A' ' 5' ' ' GLN . 7.8 tt0 -173.79 119.82 0.29 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.5 ' C ' ' O ' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -30.6 133.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.894 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -84.27 108.95 17.42 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.782 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.673 ' C ' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -136.12 168.05 23.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.401 179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.035 ' N ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -111.08 -15.86 13.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.923 0.392 . . . . 0.0 110.257 179.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -87.48 145.17 26.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.138 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.413 ' OE1' ' N ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER 59.29 16.96 5.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.225 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 85.7 p -67.9 74.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.776 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.79 -53.92 5.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.64 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -57.05 3.81 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -48.98 -18.29 0.28 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.672 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -24.83 59.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -58.39 -40.73 83.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.164 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -49.87 -41.49 45.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.26 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.457 ' NE2' ' H ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -45.56 -58.37 3.45 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.912 -179.354 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.518 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -58.92 -48.15 82.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.058 0.456 . . . . 0.0 111.312 -179.222 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.518 ' N ' ' CG2' ' A' ' 19' ' ' THR . 22.8 t80 -49.3 -59.0 4.09 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.953 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.446 HD13 ' NE2' ' A' ' 37' ' ' GLN . 21.2 mt -61.8 -39.43 91.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.029 179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.666 ' OD1' ' NH2' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -53.41 -40.81 65.4 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.647 ' O ' ' N ' ' A' ' 26' ' ' GLU . 6.6 mt-30 -59.58 -52.08 67.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.575 178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.737 HD11 ' HB1' ' A' ' 50' ' ' ALA . 9.9 mt -44.35 -36.58 2.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.588 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.666 ' NH2' ' OD1' ' A' ' 22' ' ' ASN . 2.1 ttm105 -77.43 -19.26 56.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.715 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' O ' ' A' ' 23' ' ' GLN . 2.4 tt0 -87.62 -58.59 2.52 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -178.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.576 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -60.77 -59.8 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -177.313 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.704 ' HB ' HG23 ' A' ' 51' ' ' VAL . 0.2 OUTLIER -85.08 -3.08 58.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.42 -178.725 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.413 ' HA2' ' O ' ' A' ' 25' ' ' ARG . . . 60.66 30.81 73.23 Favored Glycine 0 CA--C 1.531 1.039 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.214 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.488 ' O ' ' CG ' ' A' ' 25' ' ' ARG . 17.1 mm -82.84 147.41 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 117.213 0.507 . . . . 0.0 110.56 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -104.8 -50.67 3.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.99 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -43.36 103.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.548 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 p -68.59 -25.53 64.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.14 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -64.65 -44.86 89.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.866 0.365 . . . . 0.0 110.97 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.508 ' N ' HD12 ' A' ' 35' ' ' ILE . 1.8 mp -67.98 -25.99 33.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.451 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 36' ' ' LEU . 4.6 mt -69.81 -50.18 45.52 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.877 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.446 ' NE2' HD13 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -59.46 -32.05 69.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.093 -179.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.427 ' OE1' ' O ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -72.74 -38.18 67.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.332 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.783 ' HB2' HD21 ' A' ' 54' ' ' LEU . . . -63.98 -34.7 78.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.746 HD23 ' O ' ' A' ' 40' ' ' LEU . 3.6 tt -65.85 -44.83 84.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.162 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.9 mmtp -59.17 -34.77 72.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.74 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.512 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -86.2 -13.46 46.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.852 -179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.476 ' O ' ' CB ' ' A' ' 44' ' ' ASN . 14.4 m -97.13 -30.34 13.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.315 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.476 ' CB ' ' O ' ' A' ' 43' ' ' SER . 5.7 t30 77.73 24.38 0.75 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.134 179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.12 8.68 47.0 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.438 ' HB3' HD23 ' A' ' 49' ' ' LEU . 94.9 m-20 -97.17 130.95 44.35 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.576 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER -82.54 -63.55 1.35 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.426 -178.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.43 ' C ' HD22 ' A' ' 49' ' ' LEU . 2.6 tt0 -45.44 -21.5 0.1 Allowed 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.705 HD22 ' N ' ' A' ' 49' ' ' LEU . 3.2 mm? -87.97 -45.64 10.05 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.737 ' HB1' HD11 ' A' ' 24' ' ' LEU . . . -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.931 HG13 ' H ' ' A' ' 52' ' ' ALA . 4.2 p -59.87 -61.13 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.575 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.931 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -46.55 -42.33 15.7 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.159 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.47 ' CZ ' ' HB3' ' A' ' 42' ' ' ASP . 0.8 OUTLIER -52.7 -28.83 23.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.81 178.692 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.783 HD21 ' HB2' ' A' ' 39' ' ' ALA . 6.2 mt -83.18 -49.19 9.72 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.48 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.445 ' H ' HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER -82.35 -50.31 9.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.047 0.451 . . . . 0.0 109.889 179.486 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -40.92 157.4 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.449 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -115.83 -145.03 0.39 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.232 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.533 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 3.7 t-20 -115.13 -144.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.854 -0.338 . . . . 0.0 110.726 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 70.33 -152.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.561 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.11 173.18 0.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.805 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.535 ' N ' ' CD ' ' A' ' 62' ' ' PRO . 9.0 t -174.71 48.48 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.689 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 61' ' ' THR . 38.9 Cg_endo -71.03 -33.18 12.19 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.581 2.188 . . . . 0.0 111.606 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -62.66 -40.57 97.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.269 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.515 ' O ' ' O ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -124.98 95.1 4.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.309 179.721 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.515 ' O ' ' O ' ' A' ' 64' ' ' GLN . 5.5 mt-10 -38.4 165.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.051 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.537 ' O ' ' C ' ' A' ' 67' ' ' THR . 8.4 tp10 -125.56 -20.58 4.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.382 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.537 ' C ' ' O ' ' A' ' 66' ' ' GLU . 33.8 p 28.07 94.63 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.771 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.585 HG22 ' H ' ' A' ' 69' ' ' TYR . 6.0 m -62.19 -130.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.344 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.585 ' H ' HG22 ' A' ' 68' ' ' THR . 68.6 m-85 53.1 -164.59 0.08 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.606 ' O ' ' C ' ' A' ' 71' ' ' GLN . 58.7 t80 66.15 -80.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.818 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.606 ' C ' ' O ' ' A' ' 70' ' ' TYR . 6.7 tp-100 -8.81 -91.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.562 0.539 . . . . 0.0 111.244 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.698 HG22 ' N ' ' A' ' 73' ' ' ALA . 52.4 m -61.55 -103.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.195 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.698 ' N ' HG22 ' A' ' 72' ' ' THR . . . 59.71 135.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.92 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.4 tp -159.09 98.09 1.64 Allowed Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.135 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.78 71.22 5.56 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.301 2.001 . . . . 0.0 112.527 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -86.1 161.64 34.64 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.456 -1.058 . . . . 0.0 110.456 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.61 ' H ' HD22 ' A' ' 77' ' ' ASN . 1.3 p30 -84.2 90.6 7.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.771 0.32 . . . . 0.0 110.529 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.61 172.56 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.44 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -96.94 136.5 37.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.661 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -46.24 -46.18 17.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.633 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.12 96.11 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.562 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 67.7 m -115.82 -10.43 11.71 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.881 -179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.4 t -111.18 44.61 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.603 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.437 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . -89.98 -92.37 1.21 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.437 ' CB ' ' O ' ' A' ' 84' ' ' GLY . 3.0 t 75.92 15.15 2.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.792 0.329 . . . . 0.0 110.72 179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -105.92 -89.01 0.44 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.615 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.98 134.58 50.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.671 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.568 ' O ' ' O ' ' A' ' 89' ' ' THR . 12.6 m-20 -108.43 94.44 5.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.301 179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.568 ' O ' ' O ' ' A' ' 88' ' ' ASP . 2.4 t -23.46 143.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.813 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.533 ' O ' ' CG ' ' A' ' 90' ' ' ASN . 0.4 OUTLIER -157.24 4.37 0.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.75 ' C ' HG22 ' A' ' 92' ' ' ILE . 1.2 m -85.89 156.67 3.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.886 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.75 HG22 ' C ' ' A' ' 91' ' ' VAL . 1.5 tt 157.28 164.64 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.851 178.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.642 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 1.6 p30 179.09 105.61 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.366 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.997 ' H ' HD12 ' A' ' 94' ' ' LEU . 0.6 OUTLIER -86.77 -25.56 24.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.721 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 t -99.17 -16.89 18.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.62 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.522 ' C ' ' OD1' ' A' ' 97' ' ' ASP . . . 51.76 48.38 50.66 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.881 -0.887 . . . . 0.0 110.881 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.595 ' N ' ' OD1' ' A' ' 97' ' ' ASP . 0.2 OUTLIER 69.84 125.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.776 0.322 . . . . 0.0 110.516 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.12 94.11 4.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.443 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -92.13 -45.58 8.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.457 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.22 -33.65 43.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.585 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -72.5 -19.61 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.563 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.592 ' C ' ' N ' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -75.55 -53.41 8.67 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.484 179.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.429 ' HA ' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -43.91 -19.39 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 178.755 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.592 ' N ' ' C ' ' A' ' 102' ' ' LEU . 9.6 mtp180 -87.22 -39.21 15.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.391 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.577 ' N ' ' O ' ' A' ' 102' ' ' LEU . . . -52.88 -57.24 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.506 ' H ' ' CD1' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -64.83 -55.35 21.4 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.615 0 CA-C-O 121.602 0.715 . . . . 0.0 110.339 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -43.01 -46.15 5.4 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.652 -179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.682 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -59.24 -46.52 88.26 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.848 180.0 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.519 ' C ' ' N ' ' A' ' 111' ' ' ALA . 6.7 t -68.43 -53.21 25.14 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.616 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 tp -47.48 -17.77 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 108' ' ' LEU . . . -79.99 -56.96 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.576 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -46.32 -24.25 0.46 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.624 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.649 ' O ' ' N ' ' A' ' 115' ' ' ARG . 58.2 m -90.54 -47.73 7.52 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.178 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 113' ' ' SER . 16.0 m120 -39.54 -19.14 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.075 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.649 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -112.86 -28.85 7.59 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.547 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.482 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -97.59 2.04 49.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.236 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.606 ' N ' ' O ' ' A' ' 113' ' ' SER . 3.5 t80 -91.14 -66.31 0.94 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.239 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.672 ' H ' ' HD2' ' A' ' 118' ' ' ARG . 0.0 OUTLIER -38.0 -86.33 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.869 179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 65.32 66.47 0.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.567 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.458 ' H ' HG22 ' A' ' 120' ' ' THR . 1.5 t -76.13 80.84 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.458 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -154.55 115.24 0.66 Allowed Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tt -128.46 145.58 35.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.722 0.296 . . . . 0.0 110.389 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.521 ' O ' HG22 ' A' ' 123' ' ' THR . 30.2 m -106.4 -1.81 22.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.866 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.19 -24.16 57.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.624 -179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.583 ' OE1' ' N ' ' A' ' 126' ' ' GLU . 2.4 tm-20 -58.13 -57.01 14.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.472 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.583 ' N ' ' OE1' ' A' ' 125' ' ' GLU . 20.2 tt0 -48.78 -43.04 37.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.268 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.66 -45.93 92.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.255 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -51.44 -59.39 4.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.377 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 3.5 mm -42.78 -55.65 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.781 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.05 -52.09 12.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.736 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -46.6 -48.49 19.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.592 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.93 -54.66 28.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.786 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -49.7 -44.29 48.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.784 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.68 -61.24 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -41.98 -30.13 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.423 ' C ' ' H ' ' A' ' 138' ' ' ALA . 1.6 t -71.32 -67.83 0.49 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.492 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 5.8 pt -65.1 -0.3 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.503 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.423 ' H ' ' C ' ' A' ' 136' ' ' SER . . . -107.47 12.16 28.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.757 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.457 ' CG ' ' H ' ' A' ' 140' ' ' ASN . 0.6 OUTLIER -117.23 -133.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.737 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.457 ' H ' ' CG ' ' A' ' 139' ' ' GLU . 10.8 t-20 -134.63 152.42 51.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.657 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 15.2 mtmm -82.66 -120.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.601 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.605 ' C ' ' SG ' ' A' ' 143' ' ' CYS . . . -90.04 -138.49 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.728 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.605 ' SG ' ' C ' ' A' ' 142' ' ' ALA . 2.7 m 82.07 52.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.592 ' C ' ' H ' ' A' ' 146' ' ' ARG . 2.8 mt -156.39 -49.8 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.718 -179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -66.36 16.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.815 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.592 ' H ' ' C ' ' A' ' 144' ' ' LEU . 80.1 mtt-85 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.503 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -157.74 37.32 0.27 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.77 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.432 ' H ' HG23 ' A' ' 3' ' ' VAL . 2.4 t -52.95 96.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.799 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -115.11 140.43 49.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.182 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.515 ' O ' ' OD1' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -154.04 -141.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.839 0.352 . . . . 0.0 110.978 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.515 ' OD1' ' O ' ' A' ' 5' ' ' GLN . 0.5 OUTLIER 160.83 -173.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.323 -179.84 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.3 p 178.82 142.64 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.83 0.348 . . . . 0.0 110.82 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.802 HD23 ' H ' ' A' ' 9' ' ' GLN . 0.4 OUTLIER -168.32 156.93 8.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.644 179.717 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.802 ' H ' HD23 ' A' ' 8' ' ' LEU . 18.7 tt0 -126.31 -143.14 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.088 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.438 ' H ' ' HG2' ' A' ' 9' ' ' GLN . 0.0 OUTLIER 69.93 131.55 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.733 179.856 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -168.27 1.8 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.563 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.73 -56.44 3.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.641 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -85.37 -56.44 3.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.705 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -48.37 -22.23 0.66 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.187 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.7 tttt -49.04 -25.62 2.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.116 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -73.51 -59.17 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.512 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.531 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.8 OUTLIER -59.57 -29.9 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 179.152 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.595 ' O ' ' CB ' ' A' ' 22' ' ' ASN . 4.7 mt-30 -71.64 -25.22 62.06 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.316 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -71.08 -51.38 25.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.228 0.537 . . . . 0.0 110.484 -179.527 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.595 ' N ' ' CG2' ' A' ' 19' ' ' THR . 42.6 t80 -60.02 -53.92 52.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.032 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.531 HD12 ' O ' ' A' ' 17' ' ' GLN . 13.3 mt -59.8 -45.75 91.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.148 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.595 ' CB ' ' O ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -50.05 -49.7 50.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.462 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.601 ' O ' ' N ' ' A' ' 26' ' ' GLU . 3.3 mm100 -54.9 -56.05 23.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.92 178.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.571 HD11 ' HB3' ' A' ' 50' ' ' ALA . 1.1 tp -44.92 -28.79 0.71 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.319 178.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.59 -24.26 24.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.152 0.501 . . . . 0.0 109.939 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' A' ' 23' ' ' GLN . 62.6 tt0 -88.25 -56.67 3.22 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.54 ' CD1' HD11 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -52.88 -59.6 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 120.663 -0.415 . . . . 0.0 111.427 -176.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.622 HG22 HG23 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -87.2 -6.49 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.742 -178.996 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.421 ' O ' HG21 ' A' ' 61' ' ' THR . . . 70.99 9.9 67.33 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.35 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.527 ' CD1' ' OG1' ' A' ' 28' ' ' THR . 2.0 mm -59.43 153.31 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 117.666 0.733 . . . . 0.0 110.287 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.467 ' N ' HG22 ' A' ' 30' ' ' ILE . 4.4 p30 -113.47 -42.74 3.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.854 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' N ' ' CG ' ' A' ' 31' ' ' ASN . 2.1 m-20 -44.89 101.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.557 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.9 m -67.13 -31.51 72.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.191 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.434 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.3 OUTLIER -65.02 -37.03 86.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.857 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.434 ' N ' ' HG2' ' A' ' 34' ' ' GLN . 42.8 mm -67.24 -39.75 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.907 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.564 ' HA ' HD23 ' A' ' 24' ' ' LEU . 7.2 mt -61.19 -60.71 3.34 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.378 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -45.61 -32.87 2.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.041 0.448 . . . . 0.0 110.276 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -81.43 -30.48 33.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.816 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.544 ' O ' ' CB ' ' A' ' 43' ' ' SER . . . -74.87 -24.11 58.51 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.898 ' C ' HD13 ' A' ' 40' ' ' LEU . 2.0 tm? -77.68 -42.6 34.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.009 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -62.2 -43.22 99.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.532 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.598 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 80.4 m-20 -86.19 -22.45 26.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.796 0.331 . . . . 0.0 111.224 -179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.707 ' HA ' HD21 ' A' ' 49' ' ' LEU . 1.7 t -63.93 -30.96 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.629 -179.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.598 ' ND2' ' O ' ' A' ' 42' ' ' ASP . 0.9 OUTLIER 79.88 9.26 1.47 Allowed 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.901 -0.319 . . . . 0.0 110.496 -179.37 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.15 15.45 25.84 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.516 ' CB ' HD22 ' A' ' 49' ' ' LEU . 0.6 OUTLIER -104.85 131.07 52.79 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.716 0.293 . . . . 0.0 110.637 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.54 HD11 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -78.96 -61.07 2.13 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.006 -178.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.417 ' C ' HG12 ' A' ' 51' ' ' VAL . 5.2 mt-10 -54.01 -25.84 23.25 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 1.179 HD23 ' N ' ' A' ' 50' ' ' ALA . 0.0 OUTLIER -88.53 -25.98 22.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.232 -0.587 . . . . 0.0 110.115 -179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 1.179 ' N ' HD23 ' A' ' 49' ' ' LEU . . . -79.85 -54.21 6.04 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 177.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.857 ' O ' HG23 ' A' ' 55' ' ' THR . 11.6 p -44.11 -40.18 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.736 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.683 ' O ' ' HB2' ' A' ' 56' ' ' ALA . . . -64.9 -33.64 76.5 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 113.828 -1.533 . . . . 0.0 110.425 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.634 ' N ' ' O ' ' A' ' 50' ' ' ALA . 0.7 OUTLIER -54.35 -33.1 58.34 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 178.523 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.75 ' N ' ' CD1' ' A' ' 54' ' ' LEU . 0.6 OUTLIER -87.59 -52.48 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.836 -179.082 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.857 HG23 ' O ' ' A' ' 51' ' ' VAL . 2.8 p -70.12 -43.19 71.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.313 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' A' ' 52' ' ' ALA . . . -22.45 -39.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.734 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.695 ' N ' ' O ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -101.92 -69.98 0.76 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.609 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.613 ' O ' ' HB2' ' A' ' 59' ' ' ALA . 0.9 OUTLIER -148.81 -177.59 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.504 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.613 ' HB2' ' O ' ' A' ' 58' ' ' ASN . . . 167.67 139.58 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.813 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.591 ' O ' ' OG1' ' A' ' 61' ' ' THR . 16.0 tttt -150.9 136.15 17.68 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.473 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.591 ' OG1' ' O ' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -176.55 78.12 0.26 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.452 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -83.04 -18.82 6.06 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 C-N-CA 123.035 2.49 . . . . 0.0 112.275 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -55.6 -32.75 63.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.751 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -92.48 67.94 4.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.641 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -117.9 64.12 0.75 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.603 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.588 ' O ' ' OG1' ' A' ' 67' ' ' THR . 9.5 mp0 -106.2 104.56 14.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.698 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.588 ' OG1' ' O ' ' A' ' 66' ' ' GLU . 2.5 m -174.06 -3.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.225 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 69' ' ' TYR . 6.5 t -62.52 -41.1 98.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.588 -179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.6 ' CD2' ' O ' ' A' ' 70' ' ' TYR . 66.9 t80 61.73 112.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.498 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.6 ' O ' ' CD2' ' A' ' 69' ' ' TYR . 1.4 p90 -54.56 179.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.668 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.518 ' O ' ' O ' ' A' ' 72' ' ' THR . 0.0 OUTLIER -117.29 44.41 2.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.51 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.518 ' O ' ' O ' ' A' ' 71' ' ' GLN . 68.0 p 37.36 97.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.503 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.64 -100.4 0.3 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.574 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.727 HD23 ' H ' ' A' ' 76' ' ' GLY . 4.0 tt -132.55 95.8 19.8 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.404 ' C ' ' H ' ' A' ' 77' ' ' ASN . 62.3 Cg_exo -46.53 -29.06 6.92 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.524 2.149 . . . . 0.0 112.166 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.727 ' H ' HD23 ' A' ' 74' ' ' LEU . . . 66.47 -2.18 4.63 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.653 ' OD1' ' N ' ' A' ' 78' ' ' ASP . 51.0 t-20 37.84 -138.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 110.515 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.653 ' N ' ' OD1' ' A' ' 77' ' ' ASN . 3.8 p30 -148.29 108.73 4.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.668 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.43 ' O ' ' C ' ' A' ' 80' ' ' TYR . 11.3 mmm180 -83.37 -27.52 29.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.615 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.43 ' C ' ' O ' ' A' ' 79' ' ' ARG . 7.6 m-85 -36.44 -46.64 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.963 -179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -140.02 90.6 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -114.06 -153.58 0.53 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.124 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 11.0 m -84.89 172.96 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.348 179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.39 79.21 0.02 OUTLIER Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.2 p -116.87 -64.1 1.36 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.446 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -130.22 -137.68 0.21 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.401 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.466 ' C ' ' H ' ' A' ' 89' ' ' THR . . . -168.21 116.16 0.72 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.706 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.427 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 2.1 m-20 -74.49 34.74 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.575 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . 0.466 ' H ' ' C ' ' A' ' 87' ' ' ALA . 0.1 OUTLIER -111.01 153.2 25.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.613 -179.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' A' ' 89' ' ' THR . 0.6 OUTLIER -179.7 35.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.196 0.522 . . . . 0.0 109.601 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -102.16 175.7 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.251 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.633 ' CG1' ' N ' ' A' ' 93' ' ' ASP . 2.4 tt 177.6 164.23 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.975 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.633 ' N ' ' CG1' ' A' ' 92' ' ' ILE . 76.9 m-20 51.74 175.33 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.382 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.7 pp -129.25 -27.87 2.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.592 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.642 HG23 ' H ' ' A' ' 97' ' ' ASP . 1.9 t -91.19 -35.55 14.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.557 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.82 -17.21 20.49 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.642 ' H ' HG23 ' A' ' 95' ' ' THR . 0.1 OUTLIER 58.28 30.53 19.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 110.45 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -84.46 86.86 7.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.671 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HG3' ' H ' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -69.82 -12.53 61.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.598 179.94 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.93 -15.81 61.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.502 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -32.38 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.851 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.603 ' C ' HD12 ' A' ' 102' ' ' LEU . 1.1 pp -65.54 -33.2 75.36 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.423 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.653 ' HA ' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -57.69 -19.32 26.23 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.043 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -87.11 -29.22 22.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.166 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.96 -57.8 10.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.239 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.844 HD12 ' H ' ' A' ' 107' ' ' ALA . 0.8 OUTLIER -71.79 -35.31 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.406 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.712 -179.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.844 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -57.38 -52.54 64.94 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.2 -38.87 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.557 178.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.473 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.0 OUTLIER -70.33 -42.89 71.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.232 179.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.4 mp -48.55 -19.14 0.3 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.473 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -88.79 -58.1 2.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.406 179.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -47.43 -20.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.942 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.584 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.6 OUTLIER -88.51 -51.75 5.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.007 179.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 114' ' ' ASN . 62.1 t-20 -45.99 -12.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.584 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -101.56 -37.72 8.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.602 179.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.509 ' N ' ' O ' ' A' ' 113' ' ' SER . . . -92.9 15.17 15.44 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.058 179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.52 ' CE2' ' O ' ' A' ' 118' ' ' ARG . 3.3 p90 -58.38 164.52 2.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.692 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.52 ' O ' ' CE2' ' A' ' 117' ' ' PHE . 28.5 mtm180 -54.92 94.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.459 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.481 ' CA ' ' OE1' ' A' ' 119' ' ' GLU . 0.0 OUTLIER -83.73 36.98 0.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.958 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.56 ' OG1' ' N ' ' A' ' 121' ' ' GLY . 0.0 OUTLIER -77.05 -103.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.44 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . 0.56 ' N ' ' OG1' ' A' ' 120' ' ' THR . . . 69.7 61.7 4.25 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.685 ' O ' ' N ' ' A' ' 124' ' ' ASP . 1.2 tt -163.84 145.42 2.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.716 0.293 . . . . 0.0 110.535 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.543 ' C ' ' O ' ' A' ' 122' ' ' ILE . 43.7 m -28.29 84.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.529 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.685 ' N ' ' O ' ' A' ' 122' ' ' ILE . 0.2 OUTLIER -63.62 171.22 2.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.539 -179.783 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -68.81 -55.99 9.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.545 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.34 -40.6 65.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.392 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -25.9 65.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.5 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.597 ' O ' HG23 ' A' ' 132' ' ' VAL . . . -75.72 -57.48 3.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.702 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 19.2 mt -53.8 -45.56 62.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.677 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.405 ' O ' ' C ' ' A' ' 131' ' ' ARG . 1.4 t -60.54 -64.97 0.77 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.671 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' A' ' 130' ' ' SER . 5.7 mtp85 -38.54 -49.95 1.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 128' ' ' ALA . 46.6 t -58.75 -51.32 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.721 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.4 ' O ' ' OG ' ' A' ' 136' ' ' SER . 5.0 mt -43.46 -57.46 3.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.758 -179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.434 ' C ' ' OE1' ' A' ' 134' ' ' GLU . 11.8 tm-20 -53.11 -57.33 10.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.586 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -50.91 -26.18 5.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.626 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 132' ' ' VAL . 0.2 OUTLIER -74.76 -62.69 1.45 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.54 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 1.9 pt -66.96 -6.67 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.748 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -85.56 61.52 6.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.666 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.574 ' O ' ' O ' ' A' ' 140' ' ' ASN . 1.3 tp10 -94.59 -75.33 0.51 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.6 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.574 ' O ' ' O ' ' A' ' 139' ' ' GLU . 0.3 OUTLIER 43.15 105.74 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.638 -179.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.502 ' O ' ' C ' ' A' ' 142' ' ' ALA . 31.7 mttm -77.19 46.82 0.52 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.574 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 141' ' ' LYS . . . -32.11 97.96 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.653 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.443 ' N ' ' O ' ' A' ' 141' ' ' LYS . 4.0 m -156.45 152.84 27.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.559 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.57 ' O ' ' O ' ' A' ' 145' ' ' LYS . 4.0 mm? -72.54 171.54 12.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.711 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . 0.57 ' O ' ' O ' ' A' ' 144' ' ' LEU . 10.7 ttmm 25.81 99.75 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.867 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.401 ' HG2' ' H ' ' A' ' 146' ' ' ARG . 13.1 ptt-85 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.51 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.0 mtt . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.516 ' O ' ' C ' ' A' ' 3' ' ' VAL . 0.2 OUTLIER -94.95 78.53 3.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.398 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.718 ' O ' HG13 ' A' ' 3' ' ' VAL . 10.3 p -28.32 100.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.619 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -97.18 22.95 7.91 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.638 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -134.89 -107.9 0.22 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.388 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.78 88.83 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.814 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -131.15 -22.02 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.363 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.774 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -57.07 -52.91 63.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -63.62 -31.02 72.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.64 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -63.52 -179.52 0.36 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 3.3 t -130.8 -64.71 0.82 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.608 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.439 ' O ' ' N ' ' A' ' 14' ' ' GLN . . . -72.71 -49.7 29.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.688 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -45.01 -20.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.632 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 12' ' ' ALA . 14.0 tm0? -50.18 -18.55 0.6 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.353 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 pttm -52.14 -19.15 1.79 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.713 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -75.24 -24.45 57.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.073 -179.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.402 HE21 HD11 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -46.93 -31.41 3.13 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.396 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.498 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.6 OUTLIER -46.59 -41.88 15.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.364 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.425 ' CG2' ' N ' ' A' ' 20' ' ' PHE . 0.5 OUTLIER -68.04 -40.18 82.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.533 0.682 . . . . 0.0 109.651 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.599 ' CE1' HD22 ' A' ' 47' ' ' LEU . 10.0 t80 -57.82 -56.25 24.37 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.934 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.1 mt -64.22 -45.76 86.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.974 179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.512 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 14.0 t-20 -46.45 -38.72 9.5 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -42.99 84.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.741 179.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.825 ' O ' HG22 ' A' ' 28' ' ' THR . 20.3 mt -54.45 -58.66 6.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -59.03 -18.09 31.42 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.278 0.561 . . . . 0.0 109.702 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -76.94 -44.73 30.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.288 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.645 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -91.38 -41.31 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.46 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.423 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.825 HG22 ' O ' ' A' ' 24' ' ' LEU . 3.8 t -95.18 -4.73 45.44 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 119.612 -0.835 . . . . 0.0 111.941 -177.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 58.52 31.52 66.99 Favored Glycine 0 CA--C 1.527 0.823 0 C-N-CA 121.41 -0.424 . . . . 0.0 112.449 178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.71 ' HB ' HD21 ' A' ' 36' ' ' LEU . 47.1 mm -90.07 112.39 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 C-N-CA 120.586 -0.445 . . . . 0.0 110.056 179.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.511 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 2.5 p30 -76.66 -41.7 44.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.16 90.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.411 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.552 ' HA ' HD12 ' A' ' 36' ' ' LEU . 0.0 OUTLIER -58.03 -37.09 73.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.772 -179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.37 -44.12 84.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.031 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 38.3 mm -67.88 -28.85 42.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.253 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.728 HD22 ' HB3' ' A' ' 24' ' ' LEU . 96.3 mt -69.33 -51.78 33.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.166 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -53.22 -27.29 21.16 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.47 ' O ' ' OD1' ' A' ' 42' ' ' ASP . 0.0 OUTLIER -79.39 -25.18 42.19 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.326 179.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.98 -40.01 32.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.246 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.069 HD22 ' O ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.77 -29.7 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.019 179.834 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.859 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -69.7 -43.92 71.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.766 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.47 ' OD1' ' O ' ' A' ' 38' ' ' GLN . 1.7 m-20 -74.55 -19.31 60.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.776 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.589 ' O ' ' OD1' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -82.97 -30.79 27.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.928 -179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.589 ' OD1' ' O ' ' A' ' 43' ' ' SER . 0.1 OUTLIER 80.66 23.37 0.36 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.095 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 102.52 8.63 42.98 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.548 ' N ' ' OG ' ' A' ' 43' ' ' SER . 3.1 m120 -96.58 130.75 43.71 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.688 ' O ' HG12 ' A' ' 51' ' ' VAL . 0.1 OUTLIER -83.46 -63.05 1.43 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.447 ' C ' HD22 ' A' ' 49' ' ' LEU . 21.2 tt0 -45.56 -21.82 0.12 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.698 HD22 ' N ' ' A' ' 49' ' ' LEU . 2.8 mm? -85.87 -42.89 13.72 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.31 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.667 ' CB ' HD21 ' A' ' 24' ' ' LEU . . . -61.11 -56.74 17.34 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.991 HG13 ' H ' ' A' ' 52' ' ' ALA . 1.1 p -50.16 -65.17 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.991 ' H ' HG13 ' A' ' 51' ' ' VAL . . . -45.83 -42.26 12.14 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.037 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -54.78 -31.11 58.41 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.62 ' CD1' HD22 ' A' ' 24' ' ' LEU . 3.3 mt -87.15 -50.23 6.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.293 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -67.26 -50.55 60.08 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.658 ' N ' ' O ' ' A' ' 52' ' ' ALA . . . -47.74 -60.3 2.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.503 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.7 tptt 63.67 113.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.388 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 15.5 m120 -137.46 44.66 2.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.712 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 58' ' ' ASN . . . 69.3 127.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.892 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.631 ' O ' ' CB ' ' A' ' 61' ' ' THR . 23.4 tptt -128.69 -81.5 0.58 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.646 179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.631 ' CB ' ' O ' ' A' ' 60' ' ' LYS . 1.3 m 92.04 63.71 0.03 OUTLIER Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.13 0.491 . . . . 0.0 110.573 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.55 ' HD3' ' H ' ' A' ' 61' ' ' THR . 84.9 Cg_endo -86.05 -4.48 8.77 Favored 'Trans proline' 0 C--N 1.303 -1.864 0 C-N-CA 123.38 2.72 . . . . 0.0 111.843 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -40.03 -79.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.698 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -126.07 69.95 1.21 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.644 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -126.9 57.11 1.47 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.451 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -155.52 128.57 8.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.562 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.9 t -173.15 -13.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.235 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.404 ' OG1' ' N ' ' A' ' 69' ' ' TYR . 11.9 t -158.99 -152.17 0.31 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.229 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.525 ' CD2' ' O ' ' A' ' 69' ' ' TYR . 22.2 p90 -153.89 110.84 3.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.699 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.559 ' O ' ' O ' ' A' ' 71' ' ' GLN . 0.3 OUTLIER -128.52 -60.19 1.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.544 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.559 ' O ' ' O ' ' A' ' 70' ' ' TYR . 0.9 OUTLIER -38.29 167.77 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.783 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.405 ' C ' ' O ' ' A' ' 71' ' ' GLN . 73.7 p 38.99 68.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.329 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.71 2.34 41.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.76 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.06 122.36 74.69 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.139 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -70.74 47.97 0.76 Allowed 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.11 1.873 . . . . 0.0 112.205 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 80.16 -167.8 51.32 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.996 -0.842 . . . . 0.0 110.996 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 63.9 m-20 -97.87 -124.23 0.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.93 0.395 . . . . 0.0 110.712 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -170.78 149.74 3.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.515 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.499 ' O ' ' C ' ' A' ' 80' ' ' TYR . 12.2 mtt180 -72.23 72.13 0.9 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.567 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.499 ' C ' ' O ' ' A' ' 79' ' ' ARG . 0.2 OUTLIER -32.81 -59.04 0.35 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.337 179.879 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.06 134.89 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.31 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.486 ' O ' ' C ' ' A' ' 83' ' ' VAL . 1.4 p -173.54 -48.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.618 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.486 ' C ' ' O ' ' A' ' 82' ' ' SER . 0.0 OUTLIER -32.3 115.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.691 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -93.4 -68.07 1.08 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.661 ' O ' ' CB ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER 168.53 -84.16 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.545 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.661 ' CB ' ' O ' ' A' ' 85' ' ' SER . 5.3 tp-100 139.43 -70.33 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.987 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.521 ' O ' ' C ' ' A' ' 88' ' ' ASP . . . 55.09 -127.81 2.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.521 ' C ' ' O ' ' A' ' 87' ' ' ALA . 46.1 t0 30.59 67.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.561 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.8 m -159.42 121.18 3.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.724 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -171.45 7.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.268 0.556 . . . . 0.0 109.584 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.587 HG23 ' H ' ' A' ' 92' ' ' ILE . 0.3 OUTLIER -58.99 -91.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.308 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.818 HG23 ' N ' ' A' ' 93' ' ' ASP . 0.4 OUTLIER 33.12 -162.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.521 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.818 ' N ' HG23 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -141.15 147.06 37.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.663 -179.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -114.7 -28.8 6.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -108.22 -38.11 5.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.875 -179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 51.37 54.68 22.87 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -166.31 155.5 11.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.888 0.375 . . . . 0.0 110.656 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.725 ' O ' HD23 ' A' ' 102' ' ' LEU . 0.3 OUTLIER -59.1 157.56 10.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.544 -179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.4 mtmm -95.82 -19.09 19.88 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.596 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -86.99 -47.43 8.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.791 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.426 ' O ' ' CB ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER -51.19 -33.97 29.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.964 0.412 . . . . 0.0 110.281 179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.725 HD23 ' O ' ' A' ' 98' ' ' ASP . 4.2 mm? -55.38 -33.77 63.73 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 120.417 -0.513 . . . . 0.0 109.658 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.684 ' HA ' HD11 ' A' ' 106' ' ' ILE . 21.3 tp60 -55.18 -19.74 8.67 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.426 ' CB ' ' O ' ' A' ' 101' ' ' ASP . 23.7 ttt180 -85.92 -32.57 21.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.404 -1.271 . . . . 0.0 110.354 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.68 -57.8 11.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.547 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.684 HD11 ' HA ' ' A' ' 103' ' ' GLN . 0.7 OUTLIER -74.24 -31.86 30.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 CA-C-O 121.087 0.47 . . . . 0.0 111.188 -179.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.678 ' H ' HD12 ' A' ' 106' ' ' ILE . . . -62.15 -52.18 64.86 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.25 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 111' ' ' ALA . 4.3 mp -57.83 -38.7 76.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.987 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.503 ' C ' ' N ' ' A' ' 111' ' ' ALA . 0.2 OUTLIER -72.36 -54.66 8.8 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.191 -179.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.404 ' HA ' HD22 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -47.49 -17.93 0.11 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.537 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.503 ' N ' ' C ' ' A' ' 109' ' ' SER . . . -85.88 -47.72 9.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.301 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.426 ' O ' ' CB ' ' A' ' 116' ' ' ALA . 4.8 mm-40 -45.05 -22.53 0.1 Allowed 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.643 ' O ' ' N ' ' A' ' 115' ' ' ARG . 62.0 m -92.55 -54.63 3.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.86 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -41.3 -13.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.138 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.643 ' N ' ' O ' ' A' ' 113' ' ' SER . 0.0 OUTLIER -121.33 -32.91 3.78 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.17 179.249 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.426 ' CB ' ' O ' ' A' ' 112' ' ' GLU . . . -80.48 -7.63 59.25 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.909 -0.775 . . . . 0.0 108.909 178.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.483 ' N ' ' O ' ' A' ' 113' ' ' SER . 55.7 t80 -58.19 -110.09 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.444 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.451 ' N ' ' CG ' ' A' ' 117' ' ' PHE . 18.3 mtm180 -133.12 42.18 3.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.564 179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -82.68 33.5 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.555 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 30.4 p -67.01 178.85 1.27 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.558 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 65.22 112.12 0.01 OUTLIER Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.606 ' C ' ' H ' ' A' ' 124' ' ' ASP . 2.5 tp -91.72 25.36 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.821 0.343 . . . . 0.0 110.514 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.418 ' O ' ' C ' ' A' ' 124' ' ' ASP . 5.9 p 59.53 -6.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.611 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.653 ' N ' ' OD1' ' A' ' 124' ' ' ASP . 0.2 OUTLIER 37.36 83.45 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.539 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.541 ' H ' ' CD ' ' A' ' 125' ' ' GLU . 1.1 pm0 -70.83 -53.95 13.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.522 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -54.89 -44.77 74.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.516 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 124' ' ' ASP . 14.4 mm100 -65.02 -31.11 72.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.546 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 125' ' ' GLU . . . -59.4 -75.67 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.397 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.579 HG23 ' N ' ' A' ' 130' ' ' SER . 18.9 tt -44.58 -45.67 2.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.319 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.579 ' N ' HG23 ' A' ' 129' ' ' ILE . 4.0 p -57.55 -40.95 79.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.28 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.55 -47.54 63.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.195 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.555 ' O ' ' HB3' ' A' ' 135' ' ' ALA . 21.8 t -56.16 -43.51 76.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.123 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.39 -56.52 16.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.209 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -52.47 -37.34 56.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 132' ' ' VAL . . . -53.89 -40.97 67.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.315 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.74 -24.1 61.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.466 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.747 ' O ' ' HB3' ' A' ' 138' ' ' ALA . 49.7 mm -85.14 -28.14 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.511 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.747 ' HB3' ' O ' ' A' ' 137' ' ' ILE . . . 90.35 58.62 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.617 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -50.93 -2.23 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.229 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . 0.611 ' H ' ' C ' ' A' ' 138' ' ' ALA . 17.4 t30 -83.08 73.59 10.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.641 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.451 ' HD2' ' H ' ' A' ' 141' ' ' LYS . 1.1 mptm? -36.94 146.15 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.555 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.575 ' O ' ' O ' ' A' ' 143' ' ' CYS . . . -80.94 107.33 13.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.683 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' CYS . . . . . 0.575 ' O ' ' O ' ' A' ' 142' ' ' ALA . 0.1 OUTLIER 46.46 110.29 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.72 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 144' ' ' LEU . 0.1 OUTLIER -42.72 -58.95 2.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.315 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -176.2 77.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.526 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.482 HH11 ' HD3' ' A' ' 146' ' ' ARG . 7.0 mtp180 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.561 -179.997 . . . . . . . . 1 1 . 1 stop_ save_